data_2l4m_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 2l4m _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 ' 109' ' ' ARG . . . . . . . . . . . . . 48.6 mtt180 . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -59.43 -45.65 90.98 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.72 1.208 . . . . 0.0 111.839 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -58.3 -43.61 88.18 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.452 1.101 . . . . 0.0 112.786 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.67 -42.74 86.09 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.207 -0.933 . . . . 0.0 112.944 173.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.3 mt -55.52 -49.28 74.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.44 -53.56 50.39 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.176 0.59 . . . . 0.0 110.752 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -56.01 -44.36 78.6 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.967 1.307 . . . . 0.0 113.493 178.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -58.89 -54.22 49.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.389 1.076 . . . . 0.0 111.237 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.87 -18.96 62.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.821 -1.174 . . . . 0.0 113.187 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -73.36 -36.26 66.08 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.812 0.845 . . . . 0.0 111.294 169.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.46 -39.24 20.79 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.412 0.685 . . . . 0.0 112.408 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.05 -28.39 13.08 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.93 -168.74 24.91 Favored Glycine 0 N--CA 1.469 0.9 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 -172.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -62.96 128.26 22.56 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 124.004 3.136 . . . . 0.0 113.842 -170.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -139.97 163.17 33.39 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.07 1.348 . . . . 0.0 111.053 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -80.5 159.29 25.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.364 -1.46 . . . . 0.0 111.51 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.58 -33.52 60.41 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.558 0.743 . . . . 0.0 112.505 -177.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.25 -41.05 94.68 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.265 0.626 . . . . 0.0 111.627 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.6 t -59.44 -45.82 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.431 0.692 . . . . 0.0 109.154 174.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 mm -61.99 -43.26 97.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.492 0.717 . . . . 0.0 110.67 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.46 -54.54 45.63 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.718 1.207 . . . . 0.0 110.044 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -63.87 -34.61 78.32 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.325 0.65 . . . . 0.0 111.974 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.67 -25.39 64.78 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.7 mt -89.36 -11.98 41.76 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.475 1.51 . . . . 0.0 113.437 170.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.7 11.46 59.17 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.674 1.13 . . . . 0.0 114.204 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.1 mtt -80.08 176.88 9.35 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.043 1.737 . . . . 0.0 110.982 171.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -107.96 -38.14 5.89 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -175.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 60.0 p -129.33 155.75 45.12 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.347 -170.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.52 -28.07 66.74 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.53 -27.6 67.11 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.77 1.228 . . . . 0.0 113.472 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.17 -22.47 62.96 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.301 0.5 . . . . 0.0 111.457 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.25 -30.31 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 O-C-N 121.634 -0.667 . . . . 0.0 112.693 -177.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.41 -39.51 32.96 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.265 1.426 . . . . 0.0 112.498 -172.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -53.49 -49.82 66.69 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.272 1.029 . . . . 0.0 111.823 173.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -70.37 -42.25 72.05 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.006 1.322 . . . . 0.0 111.666 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.93 -52.87 61.37 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.843 0.857 . . . . 0.0 111.983 -177.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -33.23 75.01 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.433 0.693 . . . . 0.0 111.087 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.4 mtp85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.053 0.388 . . . . 0.0 110.887 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.94 -32.73 71.15 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.157 0.983 . . . . 0.0 111.939 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -64.45 -39.43 93.8 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.464 -1.398 . . . . 0.0 112.918 169.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.5 t -68.35 -14.37 62.94 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -115.53 15.99 16.61 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 115.853 1.797 . . . . 0.0 115.853 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.85 38.51 0.93 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.465 1.506 . . . . 0.0 113.162 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 6.6 mp -121.22 -32.26 3.93 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.507 1.523 . . . . 0.0 113.391 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mt -126.8 163.42 23.61 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.163 0.892 . . . . 0.0 113.057 175.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -148.35 117.45 6.82 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.007 1.723 . . . . 0.0 109.187 176.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -85.31 143.03 28.93 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.98 -0.45 . . . . 0.0 111.416 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -87.1 131.04 34.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.966 1.306 . . . . 0.0 109.413 170.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -70.96 -14.59 62.42 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.977 0.911 . . . . 0.0 112.365 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -83.33 -40.79 19.02 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.659 0.783 . . . . 0.0 112.604 -170.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.2 t -138.93 15.21 2.66 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.506 1.122 . . . . 0.0 113.703 178.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 53.1 40.65 31.57 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.404 1.481 . . . . 0.0 112.813 -174.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.52 119.13 24.82 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.453 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -84.68 124.87 31.98 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.59 1.156 . . . . 0.0 110.925 175.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.83 129.2 42.05 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.58 1.552 . . . . 0.0 108.542 -174.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.56 127.82 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 120.707 -1.245 . . . . 0.0 110.788 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -66.88 91.65 0.21 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.771 1.228 . . . . 0.0 112.41 -176.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 . . . . . 0 C--O 1.255 1.358 0 C-N-CA 128.484 2.713 . . . . 0.0 113.379 176.146 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 . . . . . 0 N--CA 1.475 0.811 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -64.59 -42.71 95.42 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.173 0.989 . . . . 0.0 110.311 -177.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -62.53 -49.4 75.5 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.953 0.901 . . . . 0.0 112.002 171.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.54 -45.95 84.47 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.822 0.849 . . . . 0.0 112.52 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 29.3 mt -59.84 -50.18 81.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.213 1.005 . . . . 0.0 110.86 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -64.71 -48.33 75.05 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.842 0.457 . . . . 0.0 110.813 -177.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.4 tpt85 -58.7 -44.58 90.36 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.924 1.29 . . . . 0.0 112.773 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.93 -52.99 62.7 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.678 1.191 . . . . 0.0 111.55 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.77 -19.33 63.51 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.99 -1.069 . . . . 0.0 112.648 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -72.89 -34.74 66.87 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.443 0.697 . . . . 0.0 110.82 169.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.81 -41.38 26.57 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.216 0.607 . . . . 0.0 112.098 -173.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -27.95 12.37 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.41 -167.43 24.78 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.316 -1.113 . . . . 0.0 110.316 -171.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -64.86 127.74 19.3 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.68 2.92 . . . . 0.0 114.322 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -139.42 163.25 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.446 1.499 . . . . 0.0 110.889 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -81.14 162.31 23.72 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 120.172 -1.58 . . . . 0.0 112.46 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.05 -32.04 63.7 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.364 0.666 . . . . 0.0 112.649 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.55 -41.14 89.11 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.939 -0.475 . . . . 0.0 111.41 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.86 -45.38 91.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.976 0.511 . . . . 0.0 109.768 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.9 mm -64.0 -42.65 96.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.629 0.772 . . . . 0.0 110.686 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.96 -54.44 44.79 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.713 1.205 . . . . 0.0 110.002 -178.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -64.28 -33.85 76.77 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.222 0.609 . . . . 0.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.74 -24.77 63.59 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.094 0.775 . . . . 0.0 113.094 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.2 mt -89.66 -11.94 41.03 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.351 1.46 . . . . 0.0 113.118 169.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.93 11.05 60.68 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.781 1.181 . . . . 0.0 114.136 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.06 174.98 10.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.915 1.686 . . . . 0.0 110.803 172.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -107.79 -33.97 7.1 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.3 p -133.42 156.25 48.04 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.587 1.155 . . . . 0.0 112.239 -171.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.13 -27.94 66.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.376 1.07 . . . . 0.0 113.581 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.46 -26.38 65.47 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.982 1.313 . . . . 0.0 113.702 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -69.04 -24.1 64.14 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.424 0.556 . . . . 0.0 111.345 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.25 -30.95 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 123.868 0.867 . . . . 0.0 112.659 -174.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.99 -41.1 15.71 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 125.325 1.45 . . . . 0.0 112.408 -175.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.17 -44.08 71.18 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.541 1.137 . . . . 0.0 112.9 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.02 -43.17 55.24 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.628 1.171 . . . . 0.0 112.135 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -62.45 -51.81 66.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.72 0.808 . . . . 0.0 112.313 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -34.4 77.59 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.669 0.788 . . . . 0.0 110.903 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 2.4 mtm105 -61.39 -44.16 97.62 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.007 0.367 . . . . 0.0 110.595 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.76 -34.56 78.61 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.907 0.883 . . . . 0.0 111.394 177.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -65.29 -37.64 87.77 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.849 -1.157 . . . . 0.0 113.503 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.67 -18.52 63.57 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -113.72 15.71 18.71 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.32 39.22 0.96 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.451 1.501 . . . . 0.0 113.965 174.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.96 -32.11 3.79 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.228 1.811 . . . . 0.0 113.246 -178.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.7 mt -129.31 164.28 23.87 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.417 1.008 . . . . 0.0 113.47 176.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -148.85 118.23 6.9 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.52 1.928 . . . . 0.0 109.505 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -87.67 142.48 27.8 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.964 -1.085 . . . . 0.0 112.154 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.01 116.12 31.39 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 126.193 1.797 . . . . 0.0 108.001 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.42 -6.92 39.17 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.916 0.887 . . . . 0.0 112.693 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.7 mp0 -69.44 -33.78 73.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.407 1.883 . . . . 0.0 112.444 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 4.4 t -148.83 14.53 0.93 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.059 1.344 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 51.35 35.88 14.99 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 127.68 2.392 . . . . 0.0 113.28 -169.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.45 119.55 25.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.677 0.791 . . . . 0.0 110.35 -174.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -82.3 121.75 27.06 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.926 1.29 . . . . 0.0 111.091 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.75 133.6 54.92 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.164 1.786 . . . . 0.0 109.506 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.35 127.41 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.451 -1.406 . . . . 0.0 110.476 174.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.43 92.75 0.21 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.646 1.179 . . . . 0.0 111.838 -177.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.274 0 C-N-CA 127.539 2.336 . . . . 0.0 112.001 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -64.27 -39.13 93.3 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.777 0.831 . . . . 0.0 109.699 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -65.15 -51.7 59.58 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.972 0.509 . . . . 0.0 111.909 169.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.27 88.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.698 0.681 . . . . 0.0 111.891 -178.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 30.2 mt -58.34 -53.47 45.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.174 0.99 . . . . 0.0 110.643 175.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -61.42 -48.66 80.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.876 0.369 . . . . 0.0 111.256 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -64.32 -42.88 96.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.572 1.549 . . . . 0.0 112.427 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -60.57 -45.04 95.39 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.793 0.837 . . . . 0.0 112.4 174.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 82.7 mt -75.25 -25.5 58.11 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 121.355 -0.841 . . . . 0.0 112.725 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -69.12 -40.88 78.04 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.275 1.03 . . . . 0.0 110.4 169.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -75.39 -42.37 53.97 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -109.33 -16.98 13.91 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -173.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 100.89 -168.32 20.26 Favored Glycine 0 N--CA 1.466 0.67 0 C-N-CA 125.101 1.334 . . . . 0.0 110.557 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -63.09 127.37 20.07 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.757 2.305 . . . . 0.0 112.004 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -136.77 163.35 30.83 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.686 1.194 . . . . 0.0 110.712 176.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.4 mtt85 -80.79 160.48 24.85 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 120.194 -1.566 . . . . 0.0 111.726 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.94 -31.99 63.42 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -176.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.5 tp -65.62 -42.06 92.0 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.709 0.404 . . . . 0.0 111.31 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.27 -45.18 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.07 0.548 . . . . 0.0 109.575 174.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.9 mm -63.38 -42.22 95.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 123.603 0.761 . . . . 0.0 110.542 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.44 -54.27 45.85 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.601 1.16 . . . . 0.0 109.827 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -65.64 -33.5 76.05 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.051 0.54 . . . . 0.0 112.138 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.27 -24.41 64.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.674 0.789 . . . . 0.0 112.87 176.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.2 mt -90.96 -11.96 37.4 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.064 1.745 . . . . 0.0 113.472 170.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.16 10.88 61.94 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.696 1.141 . . . . 0.0 114.307 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.24 175.72 9.7 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.017 1.727 . . . . 0.0 110.807 172.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -106.48 -35.01 7.21 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -134.16 156.99 47.35 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.431 1.092 . . . . 0.0 112.445 -170.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.5 -27.32 64.35 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.423 1.089 . . . . 0.0 113.7 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.42 -22.57 61.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.679 1.591 . . . . 0.0 114.129 176.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -70.86 -25.83 62.99 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.693 0.678 . . . . 0.0 111.14 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.85 -31.47 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.986 0.914 . . . . 0.0 112.692 -173.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -46.71 -38.23 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.559 1.544 . . . . 0.0 113.224 -175.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.38 -50.07 70.69 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.284 1.433 . . . . 0.0 112.107 174.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -70.1 -41.29 74.22 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.828 1.251 . . . . 0.0 111.601 176.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.07 -53.35 51.16 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.332 0.653 . . . . 0.0 112.276 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.4 -31.72 72.13 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.647 0.779 . . . . 0.0 111.106 177.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -60.16 -47.77 84.55 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.184 0.447 . . . . 0.0 110.489 172.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.3 mtp -64.9 -34.32 78.12 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.198 0.999 . . . . 0.0 111.368 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -63.77 -40.57 97.01 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.868 -1.145 . . . . 0.0 113.038 170.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.5 m -72.24 -13.74 61.6 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -113.91 14.98 18.62 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 174.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 72.02 39.21 0.83 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.541 1.537 . . . . 0.0 114.038 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.38 -31.57 3.78 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.118 1.767 . . . . 0.0 113.366 -178.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.5 mt -128.77 163.66 24.7 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.71 1.141 . . . . 0.0 113.967 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -148.08 121.59 9.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.367 1.867 . . . . 0.0 109.424 175.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 46.6 ttp -90.35 145.81 24.67 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.293 -0.88 . . . . 0.0 112.427 173.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -93.23 128.32 39.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.162 1.385 . . . . 0.0 109.053 170.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.64 -14.47 62.49 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 121.19 -0.944 . . . . 0.0 112.295 177.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -80.58 -38.53 29.29 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.69 1.196 . . . . 0.0 113.151 -169.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -138.6 14.73 2.73 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.27 1.028 . . . . 0.0 113.084 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.668 1.987 . . . . 0.0 113.181 -174.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -90.05 119.61 30.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.069 0.948 . . . . 0.0 110.457 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -87.67 118.32 27.08 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.634 1.574 . . . . 0.0 111.631 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -117.67 136.64 53.19 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.442 1.897 . . . . 0.0 112.012 172.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.32 127.37 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.314 1.446 . . . . 0.0 111.084 174.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -66.41 89.6 0.14 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.092 1.357 . . . . 0.0 112.523 -176.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 128.041 2.536 . . . . 0.0 112.565 176.797 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 . . . . . 0 N--CA 1.482 1.129 0 CA-C-O 119.506 -0.283 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.38 -42.88 96.77 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.899 0.88 . . . . 0.0 110.952 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -51.23 64.48 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.634 0.774 . . . . 0.0 111.961 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.57 -41.11 93.94 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.408 0.683 . . . . 0.0 112.404 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 53.7 mt -58.8 -51.91 66.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 124.679 1.192 . . . . 0.0 111.048 175.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.7 -50.62 71.74 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.16 0.584 . . . . 0.0 110.888 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -61.92 -41.82 98.37 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.909 1.684 . . . . 0.0 112.238 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -59.89 -54.45 46.08 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.434 1.094 . . . . 0.0 111.496 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.95 -19.23 63.38 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.647 -1.283 . . . . 0.0 113.178 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -73.56 -36.26 65.59 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.988 0.915 . . . . 0.0 111.361 169.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -83.24 -39.53 20.77 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.261 0.624 . . . . 0.0 112.34 -173.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.32 -28.92 13.08 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -167.19 23.8 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -172.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -64.29 126.71 17.56 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 124.091 3.194 . . . . 0.0 114.262 -169.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -140.58 163.01 34.0 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.437 1.495 . . . . 0.0 111.274 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -79.56 161.87 25.7 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.058 -1.651 . . . . 0.0 112.561 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.48 -33.46 63.7 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.47 0.708 . . . . 0.0 112.249 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -64.99 -41.79 95.09 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.023 -0.423 . . . . 0.0 111.289 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 28.4 t -59.45 -45.27 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.16 0.584 . . . . 0.0 109.856 174.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.8 mm -62.47 -43.79 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 123.952 0.901 . . . . 0.0 110.43 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.33 -53.72 54.94 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.615 1.166 . . . . 0.0 110.015 -177.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -63.52 -34.0 76.81 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.2 0.6 . . . . 0.0 112.071 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.96 -25.58 64.62 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.6 mt -87.93 -11.91 46.2 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.781 1.632 . . . . 0.0 112.998 169.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.05 11.29 57.75 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.894 1.235 . . . . 0.0 114.26 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 31.5 mtt -81.47 176.88 9.32 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.441 1.896 . . . . 0.0 111.414 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -108.23 -31.91 7.7 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 68.4 p -134.85 155.02 51.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.551 1.14 . . . . 0.0 112.492 -169.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.02 -26.04 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.224 1.009 . . . . 0.0 113.667 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -68.4 -27.64 66.39 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.654 1.182 . . . . 0.0 113.679 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.28 -23.19 62.83 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.044 0.45 . . . . 0.0 111.431 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.05 -31.37 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.212 -0.93 . . . . 0.0 112.666 -177.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.62 -40.87 20.64 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.51 1.524 . . . . 0.0 112.539 -173.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -42.38 71.74 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 175.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -78.12 -42.08 33.04 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.83 0.852 . . . . 0.0 112.216 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.5 -52.39 65.41 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.84 0.856 . . . . 0.0 112.398 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -35.01 79.27 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.409 0.684 . . . . 0.0 110.973 179.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.2 mtp-105 -60.77 -45.44 94.32 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.411 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.58 -35.63 81.62 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.32 1.048 . . . . 0.0 111.548 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -64.31 -38.52 91.32 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.839 -1.163 . . . . 0.0 113.529 171.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.1 t -69.72 -17.9 63.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 174.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -113.83 15.3 18.67 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.84 38.52 0.93 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.561 1.544 . . . . 0.0 113.613 175.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.47 -32.04 3.92 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.946 1.698 . . . . 0.0 113.343 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -127.35 163.94 22.89 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 119.386 0.993 . . . . 0.0 113.275 175.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -148.34 115.33 6.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.167 2.187 . . . . 0.0 108.988 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.8 ttp -87.97 143.97 26.81 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.493 -0.754 . . . . 0.0 111.679 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.91 124.77 45.58 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 125.15 1.38 . . . . 0.0 110.265 175.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.69 -5.79 40.0 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.21 -0.931 . . . . 0.0 113.03 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -83.51 -33.65 25.49 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.729 1.212 . . . . 0.0 112.731 -176.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.3 t -143.96 10.75 1.56 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.879 1.272 . . . . 0.0 113.336 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.3 mmmt 52.81 36.75 22.2 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.388 2.275 . . . . 0.0 113.439 -169.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.94 119.35 27.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.614 0.766 . . . . 0.0 110.101 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.98 122.53 27.9 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 124.72 1.208 . . . . 0.0 110.857 172.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.14 130.61 51.37 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.145 1.778 . . . . 0.0 108.673 -178.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.37 127.81 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 120.747 -1.221 . . . . 0.0 110.506 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -67.99 89.17 0.29 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.922 1.289 . . . . 0.0 111.886 -177.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? . . . . . 0 C--O 1.251 1.174 0 C-N-CA 127.358 2.263 . . . . 0.0 111.297 -179.226 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 . . . . . 0 N--CA 1.475 0.8 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -55.92 -47.92 76.64 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.833 0.742 . . . . 0.0 111.728 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -58.13 -50.56 73.06 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.434 0.693 . . . . 0.0 112.467 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -42.72 99.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.318 176.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 48.9 mt -56.41 -51.49 63.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 111.148 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.7 t80 -65.13 -50.44 66.0 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.593 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -55.51 -49.1 73.48 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.73 1.212 . . . . 0.0 112.157 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -56.18 -53.91 51.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.03 0.932 . . . . 0.0 111.455 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.4 mt -70.77 -19.63 62.69 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 120.802 -1.187 . . . . 0.0 112.944 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.59 -37.4 68.16 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.915 0.78 . . . . 0.0 110.895 169.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -81.22 -39.52 25.25 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.16 -28.22 13.13 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.13 -167.84 25.41 Favored Glycine 0 N--CA 1.471 0.97 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 -171.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -64.55 128.38 21.08 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.761 2.974 . . . . 0.0 114.103 -169.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.9 mm-40 -140.29 162.79 34.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.366 1.466 . . . . 0.0 110.662 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -81.32 161.4 23.87 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 120.159 -1.588 . . . . 0.0 112.008 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.02 -31.93 63.54 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.052 0.541 . . . . 0.0 112.326 -177.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.2 tp -65.16 -42.0 94.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.948 -0.47 . . . . 0.0 111.219 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.6 t -59.0 -44.99 92.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.055 0.542 . . . . 0.0 109.803 173.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 mm -63.88 -43.6 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.745 0.818 . . . . 0.0 110.78 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.08 -54.22 45.93 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.131 1.372 . . . . 0.0 110.153 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -64.17 -34.21 77.56 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.972 0.509 . . . . 0.0 111.964 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.99 -25.92 64.76 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.8 mt -86.68 -11.96 49.75 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.684 1.594 . . . . 0.0 113.134 169.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.37 11.67 60.72 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.708 1.147 . . . . 0.0 113.901 -178.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.0 mmt -85.64 175.69 8.61 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.448 1.899 . . . . 0.0 111.004 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -107.94 -36.58 6.32 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -173.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.7 p -127.12 155.7 42.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.598 1.159 . . . . 0.0 112.403 -171.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.28 -24.64 66.54 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.508 1.123 . . . . 0.0 113.265 175.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -67.4 -28.16 67.68 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.02 1.328 . . . . 0.0 113.402 174.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -71.74 -15.42 62.19 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.268 0.627 . . . . 0.0 112.479 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -113.59 -31.09 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.427 1.091 . . . . 0.0 113.062 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.32 -41.99 40.19 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.878 1.271 . . . . 0.0 112.213 -175.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 -55.33 -37.72 67.79 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.44 1.096 . . . . 0.0 113.215 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -81.16 -45.51 16.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.289 1.036 . . . . 0.0 111.558 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.5 mt -58.57 -52.51 65.37 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.327 -178.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.57 -34.48 77.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.036 0.934 . . . . 0.0 111.033 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.7 mtp-105 -64.28 -45.02 89.83 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.279 174.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.96 -35.36 79.9 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.14 0.976 . . . . 0.0 110.801 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -63.4 -40.17 96.5 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.8 -1.188 . . . . 0.0 112.996 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 43.2 m -73.96 -13.82 60.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.568 1.147 . . . . 0.0 114.032 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -113.85 15.42 18.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.753 1.621 . . . . 0.0 115.04 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 72.43 39.05 0.76 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.584 1.554 . . . . 0.0 114.178 175.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -122.82 -31.87 3.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.184 1.794 . . . . 0.0 113.371 -177.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mt -128.87 166.24 19.47 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.575 1.08 . . . . 0.0 113.732 176.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -149.17 119.43 7.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.322 1.849 . . . . 0.0 109.556 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.7 ttp -86.75 144.27 27.15 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.208 -0.932 . . . . 0.0 111.922 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -86.94 130.98 34.23 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.943 1.297 . . . . 0.0 109.813 171.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.06 -10.4 59.73 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 124.637 1.175 . . . . 0.0 112.957 173.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -87.99 -38.53 15.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.409 0.684 . . . . 0.0 112.758 -171.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.6 t -143.74 18.9 1.83 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.176 0.99 . . . . 0.0 113.656 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.78 39.3 28.5 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.303 1.841 . . . . 0.0 113.512 -175.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.6 118.3 25.02 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.935 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -82.92 124.32 30.24 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 110.725 175.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.74 133.13 50.94 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.792 1.637 . . . . 0.0 108.869 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.33 131.61 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.564 1.146 . . . . 0.0 110.743 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -67.87 98.01 0.7 Allowed 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.946 0.879 . . . . 0.0 111.212 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 . . . . . 0 C--O 1.254 1.294 0 C-N-CA 127.215 2.206 . . . . 0.0 112.108 -176.819 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.567 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.06 -48.16 70.88 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.138 0.881 . . . . 0.0 111.915 174.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -55.26 -52.1 64.5 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.313 1.045 . . . . 0.0 112.588 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -38.44 85.24 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.377 179.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 44.3 mt -57.33 -50.42 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 119.287 0.949 . . . . 0.0 110.873 178.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -63.84 -51.36 65.02 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.329 0.652 . . . . 0.0 110.694 -178.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -57.95 -43.96 86.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.09 1.356 . . . . 0.0 112.921 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -59.66 -53.69 55.1 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.297 1.039 . . . . 0.0 111.422 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.68 -18.96 62.82 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.827 -1.171 . . . . 0.0 113.04 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -73.48 -36.36 65.8 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.696 0.799 . . . . 0.0 110.891 169.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.64 -38.55 23.37 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.28 0.632 . . . . 0.0 112.378 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.17 -27.7 13.08 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 95.81 -167.7 25.76 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -63.76 127.76 20.43 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 124.05 3.167 . . . . 0.0 114.228 -169.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -141.3 162.36 35.68 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.401 1.48 . . . . 0.0 111.281 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 -80.57 161.38 24.8 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 120.159 -1.588 . . . . 0.0 112.298 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . 0.401 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.82 -32.33 63.47 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.19 0.596 . . . . 0.0 112.428 -177.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.3 tp -66.38 -39.98 89.42 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.832 -0.543 . . . . 0.0 111.347 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 32.4 t -59.88 -45.7 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 122.927 0.491 . . . . 0.0 109.676 173.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.401 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -63.16 -43.38 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.93 0.892 . . . . 0.0 110.688 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.58 -55.11 35.85 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.203 1.401 . . . . 0.0 110.15 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -64.67 -33.95 77.14 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.939 0.496 . . . . 0.0 111.925 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.85 -26.79 65.33 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 177.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.5 mt -85.96 -12.01 51.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.036 169.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.92 10.6 59.78 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.803 1.192 . . . . 0.0 113.937 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.3 mmt -83.44 176.81 8.8 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.402 1.881 . . . . 0.0 111.109 175.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 88.3 mmt-85 -108.14 -31.06 8.07 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -174.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 66.5 p -135.58 156.56 48.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.337 1.055 . . . . 0.0 112.335 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.17 -25.18 66.84 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.646 1.178 . . . . 0.0 113.371 176.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.04 -27.48 66.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.267 1.427 . . . . 0.0 113.476 174.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.89 -15.33 62.11 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.384 0.673 . . . . 0.0 112.258 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.54 -31.56 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 124.398 1.079 . . . . 0.0 113.061 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -48.29 -40.72 25.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.056 1.343 . . . . 0.0 112.729 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -55.82 -44.38 77.86 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.727 1.211 . . . . 0.0 112.683 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.22 -43.02 58.79 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.653 1.181 . . . . 0.0 111.849 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.97 -52.43 65.03 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.124 0.97 . . . . 0.0 112.131 -176.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.11 79.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.304 0.641 . . . . 0.0 110.768 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 -64.3 -42.06 96.54 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 118.523 -0.751 . . . . 0.0 110.857 176.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.33 -34.91 79.22 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.187 0.995 . . . . 0.0 111.411 175.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -64.98 -38.26 90.39 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.791 -1.193 . . . . 0.0 113.232 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.58 -17.49 63.55 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -113.73 15.2 18.8 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.49 38.68 0.98 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.6 1.56 . . . . 0.0 113.824 175.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.8 mp -120.63 -32.67 3.99 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.008 1.723 . . . . 0.0 112.959 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mt -129.11 164.29 23.63 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 177.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -149.3 115.38 5.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.274 1.83 . . . . 0.0 109.603 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.3 ttp -84.0 145.15 28.67 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 111.802 174.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -91.11 130.36 37.01 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.049 1.339 . . . . 0.0 109.815 171.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.66 -9.22 58.44 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 124.084 0.954 . . . . 0.0 113.05 173.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -87.45 -36.67 17.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.564 0.746 . . . . 0.0 112.865 -172.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.1 t -143.62 18.01 1.84 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.222 1.009 . . . . 0.0 113.551 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 52.39 40.0 28.58 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 126.813 2.045 . . . . 0.0 113.826 -175.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.74 119.74 27.29 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.426 0.691 . . . . 0.0 109.79 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -82.96 125.15 31.07 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.773 1.229 . . . . 0.0 110.953 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.2 p -130.58 128.29 40.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.234 1.414 . . . . 0.0 108.594 -173.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.62 129.16 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 120.597 -1.315 . . . . 0.0 110.947 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.33 89.25 0.33 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.689 1.195 . . . . 0.0 112.216 -177.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 C--O 1.253 1.239 0 C-N-CA 127.204 2.202 . . . . 0.0 112.012 178.018 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 . . . . . 0 N--CA 1.478 0.948 0 CA-C-O 119.439 -0.315 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.52 -44.8 89.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.91 0.884 . . . . 0.0 110.058 173.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.16 -55.17 31.33 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.835 0.854 . . . . 0.0 113.081 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -40.53 93.11 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 118.769 0.713 . . . . 0.0 112.324 -177.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 55.5 mt -61.91 -51.87 67.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 119.426 1.012 . . . . 0.0 111.381 178.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -64.02 -48.41 76.47 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.419 0.288 . . . . 0.0 110.782 -177.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -55.57 -50.53 69.82 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.1 1.36 . . . . 0.0 112.382 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.87 -52.04 65.46 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.922 0.889 . . . . 0.0 111.568 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.28 -19.79 63.08 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.92 -1.112 . . . . 0.0 112.931 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -73.3 -37.02 66.36 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.904 0.774 . . . . 0.0 111.185 169.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -80.73 -38.39 28.83 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 -173.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.18 -27.99 12.91 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -168.87 24.85 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -172.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -62.06 128.35 23.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.033 3.155 . . . . 0.0 113.888 -171.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.5 mm-40 -141.34 163.94 31.58 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.222 1.409 . . . . 0.0 111.189 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 52.2 mtt85 -81.63 159.98 23.87 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 120.322 -1.486 . . . . 0.0 111.928 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.66 -32.45 63.23 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.221 0.608 . . . . 0.0 112.535 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.18 -42.05 94.01 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.792 0.437 . . . . 0.0 111.38 177.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.02 -44.73 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.226 0.61 . . . . 0.0 109.647 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.7 mm -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.432 0.693 . . . . 0.0 110.853 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.3 -53.97 49.48 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.052 1.341 . . . . 0.0 110.047 -178.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -63.95 -34.07 77.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.223 0.609 . . . . 0.0 112.022 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.82 -24.58 64.4 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.6 mt -89.99 -11.94 40.12 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.386 1.474 . . . . 0.0 113.168 169.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.04 10.46 61.16 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 125.007 1.289 . . . . 0.0 113.942 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.5 mmt -82.78 173.57 11.75 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.906 1.682 . . . . 0.0 110.684 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -108.03 -30.65 8.33 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -169.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 67.7 p -135.97 155.98 49.45 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.633 1.173 . . . . 0.0 112.012 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.85 -27.65 65.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.31 -25.56 64.29 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.898 1.279 . . . . 0.0 113.721 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.22 -27.48 66.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.272 0.558 . . . . 0.0 111.113 176.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.52 -31.18 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 123.62 0.768 . . . . 0.0 112.457 -172.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.37 -41.0 12.89 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 112.401 -175.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -54.2 -44.32 71.51 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.732 1.213 . . . . 0.0 113.261 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.27 -42.64 44.88 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.999 0.92 . . . . 0.0 111.568 175.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.17 -52.84 63.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.923 . . . . 0.0 112.255 -177.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -34.03 77.44 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.783 0.833 . . . . 0.0 111.081 176.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.1 mtp85 -58.98 -46.99 86.75 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.39 173.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 41.1 mtm -64.28 -34.65 78.6 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.427 0.691 . . . . 0.0 112.274 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -65.01 -34.34 78.21 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.1 t -75.29 -16.27 60.44 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 173.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -114.04 15.23 18.42 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 6.0 t60 71.54 40.0 0.85 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.494 1.518 . . . . 0.0 114.068 175.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.85 -33.13 3.41 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.249 1.82 . . . . 0.0 113.304 -177.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.7 mt -129.51 163.95 24.81 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.737 1.153 . . . . 0.0 113.575 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -149.06 117.02 6.31 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.208 1.803 . . . . 0.0 109.772 176.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.0 ttp -85.38 143.66 28.49 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.106 0.562 . . . . 0.0 112.088 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.23 123.59 42.39 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 125.909 1.684 . . . . 0.0 109.688 172.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.25 -5.5 36.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.736 0.814 . . . . 0.0 112.876 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -75.84 -36.25 59.7 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.189 1.395 . . . . 0.0 112.355 -178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -148.2 16.45 1.06 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mptt 52.69 40.9 31.13 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.501 1.92 . . . . 0.0 113.004 -170.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -81.88 118.79 23.2 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.663 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -84.22 124.78 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.929 1.291 . . . . 0.0 110.819 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.5 p -130.47 127.99 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.173 1.389 . . . . 0.0 108.385 -172.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.47 130.48 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 120.606 -1.309 . . . . 0.0 111.077 -179.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.84 96.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 122.221 1.01 . . . . 0.0 111.793 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.806 2.443 . . . . 0.0 110.937 -176.362 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -60.84 -45.73 93.32 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.22 0.918 . . . . 0.0 111.108 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.39 -49.5 77.04 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -43.86 95.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.727 0.811 . . . . 0.0 112.381 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 34.5 mt -58.59 -50.84 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.65 1.18 . . . . 0.0 111.508 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -62.64 -51.49 67.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.945 0.498 . . . . 0.0 111.076 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -61.22 -39.78 91.53 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.436 1.094 . . . . 0.0 112.344 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.48 -54.24 47.91 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.472 1.109 . . . . 0.0 111.482 173.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.46 -18.87 63.76 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.737 -1.227 . . . . 0.0 112.989 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -73.79 -37.15 65.04 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.896 0.878 . . . . 0.0 111.454 169.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.67 -38.89 25.18 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.323 0.649 . . . . 0.0 112.278 -173.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.09 -29.16 11.92 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.76 -167.82 23.37 Favored Glycine 0 N--CA 1.469 0.857 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -172.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.23 128.14 19.82 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.772 2.981 . . . . 0.0 113.814 -170.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -139.06 162.66 34.39 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.585 1.554 . . . . 0.0 111.19 -178.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -79.27 158.16 27.61 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.196 -1.565 . . . . 0.0 111.05 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.85 -31.72 59.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.262 0.625 . . . . 0.0 112.439 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.6 tp -64.86 -41.32 95.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.165 0.586 . . . . 0.0 111.699 177.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.24 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.565 0.746 . . . . 0.0 109.121 174.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 mm -61.52 -43.63 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.529 0.732 . . . . 0.0 110.453 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.19 -55.58 31.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.234 1.414 . . . . 0.0 109.875 -178.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -63.85 -34.63 78.37 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.289 0.636 . . . . 0.0 111.986 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.24 64.28 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.2 mt -89.96 -11.96 40.16 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.488 1.515 . . . . 0.0 113.236 170.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 95.64 5.88 59.87 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.288 1.423 . . . . 0.0 114.248 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 20.4 mmm -80.93 173.77 12.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.557 1.543 . . . . 0.0 110.902 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -106.77 -29.91 9.25 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -170.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.9 p -137.77 156.37 48.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.412 1.085 . . . . 0.0 112.206 -171.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.94 -28.66 64.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.345 1.058 . . . . 0.0 113.833 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.74 -25.1 63.67 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.866 1.266 . . . . 0.0 113.705 176.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.23 -28.5 67.29 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.219 0.533 . . . . 0.0 110.915 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -31.47 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.531 0.732 . . . . 0.0 112.334 -172.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.29 -41.64 6.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.029 1.732 . . . . 0.0 112.872 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -44.84 75.73 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.621 1.168 . . . . 0.0 112.769 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -77.19 -38.7 51.0 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.033 0.933 . . . . 0.0 112.625 175.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.19 -51.4 67.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.768 0.827 . . . . 0.0 112.215 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -33.12 75.29 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.969 -0.457 . . . . 0.0 111.005 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -64.47 -41.22 96.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.355 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.3 mtp -63.86 -37.23 86.64 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.258 0.936 . . . . 0.0 111.997 172.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 120.452 -1.405 . . . . 0.0 112.321 173.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.6 t -67.04 -14.32 62.78 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.231 1.412 . . . . 0.0 114.111 175.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 -113.25 13.23 19.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.547 1.139 . . . . 0.0 114.009 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.6 t60 69.01 39.37 1.79 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.122 1.369 . . . . 0.0 113.087 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -121.71 -34.2 3.45 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.196 1.398 . . . . 0.0 113.478 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.5 mp -119.63 160.35 22.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.799 1.24 . . . . 0.0 112.673 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -144.38 115.38 7.86 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.966 1.706 . . . . 0.0 109.87 174.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.4 ttp -85.83 144.12 27.89 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.298 0.57 . . . . 0.0 111.979 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.15 119.93 40.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.862 1.665 . . . . 0.0 107.999 173.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.97 -12.47 60.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.906 0.882 . . . . 0.0 113.286 -172.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -77.52 -35.0 53.84 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.428 1.491 . . . . 0.0 112.68 -170.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.8 t -135.09 11.79 3.58 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.701 1.2 . . . . 0.0 112.797 171.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm 53.44 38.94 29.17 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.128 1.771 . . . . 0.0 112.232 -169.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.82 116.05 19.76 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.344 0.658 . . . . 0.0 109.438 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -81.08 125.37 30.12 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.628 1.171 . . . . 0.0 110.533 171.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.04 163.6 17.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 107.621 176.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.94 130.03 36.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 120.817 -1.177 . . . . 0.0 109.467 172.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -68.03 89.62 0.3 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.927 1.291 . . . . 0.0 111.539 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.4 ptt180 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 127.075 2.15 . . . . 0.0 113.004 178.254 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 . . . . . 0 N--CA 1.479 1.011 0 CA-C-O 119.567 -0.254 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -61.32 -43.14 99.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 122.943 0.497 . . . . 0.0 110.809 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.44 -48.79 80.3 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 122.003 -0.436 . . . . 0.0 112.091 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.565 0.746 . . . . 0.0 112.271 178.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 25.1 mt -55.89 -51.27 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.985 1.314 . . . . 0.0 111.332 177.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -63.49 -51.45 65.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.716 0.406 . . . . 0.0 111.025 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -56.49 -41.63 76.93 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.983 1.313 . . . . 0.0 112.67 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -62.75 -53.26 57.02 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.844 1.258 . . . . 0.0 111.49 175.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.71 -18.71 63.56 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.884 -1.135 . . . . 0.0 112.681 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -73.7 -37.12 65.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 118.938 0.79 . . . . 0.0 111.474 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.96 -38.71 27.24 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.384 0.674 . . . . 0.0 112.319 -173.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -28.69 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.76 -169.23 25.52 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.95 130.24 26.97 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.497 2.798 . . . . 0.0 114.09 -170.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -139.07 163.56 32.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.604 1.562 . . . . 0.0 110.832 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -78.61 157.67 28.65 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 120.21 -1.556 . . . . 0.0 111.106 177.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -53.26 -33.92 55.09 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.759 0.824 . . . . 0.0 112.524 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.07 -41.26 95.27 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.331 0.652 . . . . 0.0 111.879 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.6 t -59.61 -46.05 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.8 mm -60.74 -43.18 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.347 0.659 . . . . 0.0 110.328 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.5 -54.21 49.44 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.024 -177.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.86 -33.51 76.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.313 0.645 . . . . 0.0 112.119 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.18 -25.13 64.19 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 123.673 0.789 . . . . 0.0 112.962 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.9 mt -89.95 -11.86 40.48 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.678 1.591 . . . . 0.0 113.334 170.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.48 11.48 59.45 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.689 1.138 . . . . 0.0 114.381 -178.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 33.3 mtt -80.32 176.86 9.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.218 1.807 . . . . 0.0 111.116 171.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 86.0 mtt85 -107.69 -36.8 6.32 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -175.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -132.41 157.01 45.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.459 1.104 . . . . 0.0 112.506 -170.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.45 -27.51 66.14 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.78 1.029 . . . . 0.0 113.78 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -70.58 -23.5 62.6 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.644 1.578 . . . . 0.0 113.986 175.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -71.39 -25.17 62.24 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.276 0.489 . . . . 0.0 111.078 174.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.16 -31.45 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.404 0.682 . . . . 0.0 112.634 -175.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.38 -38.58 13.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.553 1.541 . . . . 0.0 113.325 -173.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -47.6 76.86 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.668 1.587 . . . . 0.0 112.441 174.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -72.72 -41.1 65.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.863 1.265 . . . . 0.0 111.904 176.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.42 -52.14 62.81 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.676 0.79 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.63 -33.67 76.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.844 0.458 . . . . 0.0 110.676 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -67.58 -39.29 84.87 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.03 177.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.74 -37.26 85.89 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 119.704 1.138 . . . . 0.0 111.924 171.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -64.79 -41.17 96.04 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.645 -1.284 . . . . 0.0 112.194 173.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -66.62 -13.99 61.85 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.994 1.318 . . . . 0.0 114.182 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -113.17 13.0 19.18 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.821 1.248 . . . . 0.0 113.972 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.5 t60 69.49 39.32 1.61 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.225 1.41 . . . . 0.0 113.324 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -121.47 -34.27 3.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.333 1.453 . . . . 0.0 113.153 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.3 mp -119.9 160.76 22.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.931 1.293 . . . . 0.0 113.11 175.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -142.66 115.55 8.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.348 1.859 . . . . 0.0 110.185 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.2 ttp -88.27 143.66 26.9 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.087 -1.008 . . . . 0.0 112.25 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -89.39 130.81 35.7 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.849 1.26 . . . . 0.0 108.342 169.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.52 -14.11 61.16 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 121.09 -1.006 . . . . 0.0 112.536 175.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -85.35 -37.65 19.66 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -169.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -137.17 13.43 3.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.437 1.095 . . . . 0.0 113.148 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 52.52 42.14 31.25 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.221 1.809 . . . . 0.0 113.035 -176.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.13 117.61 25.98 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.903 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -83.98 120.0 25.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.633 1.173 . . . . 0.0 110.639 173.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.22 165.5 11.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.811 2.044 . . . . 0.0 108.786 170.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.24 127.65 39.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.471 1.108 . . . . 0.0 109.637 170.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -66.15 88.65 0.12 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.392 1.477 . . . . 0.0 112.027 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 45.8 ttm105 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 127.023 2.129 . . . . 0.0 112.037 178.877 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.96 -43.8 86.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.064 1.346 . . . . 0.0 111.045 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -64.92 -50.92 64.59 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.723 0.809 . . . . 0.0 112.385 176.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.45 -40.21 96.52 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.241 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 51.3 mt -57.91 -51.0 76.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 119.502 1.047 . . . . 0.0 110.992 176.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -63.54 -50.81 68.09 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.758 0.423 . . . . 0.0 110.663 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -58.96 -42.07 88.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.662 1.185 . . . . 0.0 112.963 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.47 -53.56 54.89 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.813 1.245 . . . . 0.0 111.685 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.91 -19.68 64.21 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.987 -1.071 . . . . 0.0 112.618 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -72.99 -37.21 67.08 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.899 0.88 . . . . 0.0 110.892 169.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -76.53 -41.26 47.36 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.947 0.499 . . . . 0.0 112.029 -174.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.12 -28.14 11.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -178.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.36 -168.48 25.53 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 -172.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -62.71 128.58 23.72 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.615 2.877 . . . . 0.0 114.155 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.0 mm-40 -138.96 164.21 30.32 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.132 1.373 . . . . 0.0 110.673 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 63.8 mtt85 -80.56 160.22 25.23 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.36 -1.462 . . . . 0.0 111.347 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.43 -33.07 63.24 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.278 0.631 . . . . 0.0 112.413 -177.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.3 tp -65.56 -39.79 92.07 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.255 0.622 . . . . 0.0 111.636 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.71 -46.3 96.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 174.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.7 mm -61.35 -43.06 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.26 0.624 . . . . 0.0 110.488 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.9 -54.31 48.4 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.662 1.185 . . . . 0.0 110.145 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.78 -33.63 76.44 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.209 0.604 . . . . 0.0 112.131 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.87 65.37 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.396 0.678 . . . . 0.0 112.789 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.1 mt -88.47 -11.89 44.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.746 1.619 . . . . 0.0 113.394 169.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 11.66 60.18 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 124.704 1.145 . . . . 0.0 114.206 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.0 mtt -79.6 176.95 9.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.23 1.812 . . . . 0.0 111.21 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.99 -35.43 6.62 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 70.2 p -133.13 155.73 48.75 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.699 1.2 . . . . 0.0 112.37 -170.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.3 -27.33 65.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.162 0.985 . . . . 0.0 113.655 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.35 -26.92 65.84 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -68.79 -25.97 64.97 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.044 0.45 . . . . 0.0 111.241 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.68 -31.11 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 121.241 -0.912 . . . . 0.0 112.509 -176.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.67 -41.59 22.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.848 1.659 . . . . 0.0 112.216 -174.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -54.67 -41.15 69.82 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.567 1.147 . . . . 0.0 113.12 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -78.68 -44.45 23.62 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.559 0.744 . . . . 0.0 111.708 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.28 -52.45 65.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.274 1.029 . . . . 0.0 112.581 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.81 81.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.758 0.823 . . . . 0.0 111.036 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -62.85 -42.01 99.58 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.796 175.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 87.5 mtp -65.77 -34.39 78.07 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.111 0.964 . . . . 0.0 111.091 176.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.9 tttp -65.12 -37.41 87.34 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.998 -1.064 . . . . 0.0 113.399 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -70.05 -18.04 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 174.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -113.75 15.85 18.64 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.44 38.6 1.0 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.487 1.515 . . . . 0.0 113.947 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.39 -32.4 3.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.966 1.707 . . . . 0.0 113.281 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.4 mt -129.08 164.51 23.13 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.491 1.041 . . . . 0.0 113.541 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -147.95 118.55 7.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.711 2.004 . . . . 0.0 109.398 175.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.6 ttp -88.35 143.15 27.19 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.132 -0.98 . . . . 0.0 112.083 173.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -87.22 129.69 34.87 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.95 1.3 . . . . 0.0 109.312 170.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -71.1 -13.0 61.81 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 124.029 0.932 . . . . 0.0 112.432 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 63.6 mm-40 -83.69 -42.6 16.45 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.121 0.968 . . . . 0.0 112.729 -171.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 21.5 t -136.82 15.48 3.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.545 1.138 . . . . 0.0 113.499 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? 52.26 40.99 30.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.553 1.541 . . . . 0.0 112.801 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.15 118.0 24.45 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.637 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -85.03 121.94 28.53 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.713 1.205 . . . . 0.0 111.149 177.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.2 133.34 54.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.994 1.718 . . . . 0.0 109.559 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.81 127.49 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 O-C-N 120.454 -1.404 . . . . 0.0 110.632 176.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.8 92.46 0.22 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.694 1.198 . . . . 0.0 111.937 -177.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.268 1.827 . . . . 0.0 113.826 178.275 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 24.5 mtm180 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.88 -45.1 95.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.544 1.065 . . . . 0.0 111.062 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.36 -47.54 85.64 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.537 0.735 . . . . 0.0 111.469 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.5 -40.7 97.76 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.826 0.85 . . . . 0.0 113.254 177.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 30.2 mt -60.87 -50.24 81.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 124.359 1.063 . . . . 0.0 111.591 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -61.33 -51.35 69.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.662 0.267 . . . . 0.0 110.79 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -58.98 -42.08 89.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.19 1.396 . . . . 0.0 113.23 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -60.63 -53.68 54.54 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.28 1.032 . . . . 0.0 111.329 174.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.43 -19.6 62.97 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.768 -1.208 . . . . 0.0 112.877 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.95 -38.07 69.85 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.554 1.142 . . . . 0.0 111.043 169.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -82.16 -39.55 23.07 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.322 0.649 . . . . 0.0 112.295 -172.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.94 -28.94 12.1 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.75 -168.19 23.6 Favored Glycine 0 N--CA 1.47 0.946 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -171.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.33 129.12 20.75 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.562 2.841 . . . . 0.0 114.063 -169.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -140.61 161.03 38.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.774 1.629 . . . . 0.0 110.967 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -78.15 161.18 27.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 119.786 -1.822 . . . . 0.0 112.428 176.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . 0.405 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.83 -31.67 62.91 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.259 0.624 . . . . 0.0 112.423 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -41.15 92.48 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.876 -0.515 . . . . 0.0 111.478 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.7 t -59.46 -46.59 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.003 0.521 . . . . 0.0 109.679 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -61.82 -43.43 97.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.087 0.955 . . . . 0.0 110.232 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.91 -54.63 44.35 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.904 1.282 . . . . 0.0 110.061 -177.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -64.45 -34.78 79.0 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.161 0.585 . . . . 0.0 112.02 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.29 -25.47 64.26 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.2 mt -89.98 -12.12 39.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.554 1.542 . . . . 0.0 113.36 171.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 9.95 62.08 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.757 1.17 . . . . 0.0 114.475 -177.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 18.0 mmt -80.63 176.64 9.62 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.34 1.456 . . . . 0.0 110.632 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -108.09 -31.64 7.86 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -172.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 58.1 p -136.83 156.96 47.81 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.417 1.087 . . . . 0.0 112.234 -171.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -29.89 65.26 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.337 1.055 . . . . 0.0 113.758 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -69.19 -25.12 64.17 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.849 1.26 . . . . 0.0 113.639 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.7 -27.55 66.05 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.193 0.451 . . . . 0.0 110.966 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.8 -31.14 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.503 0.721 . . . . 0.0 112.565 -173.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.65 -41.64 6.84 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.098 1.759 . . . . 0.0 112.591 -176.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -54.73 -44.94 74.0 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.74 1.216 . . . . 0.0 113.106 175.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.7 -41.72 52.87 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.96 0.904 . . . . 0.0 111.846 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.0 mt -60.84 -52.48 64.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.454 1.101 . . . . 0.0 112.493 -177.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -33.1 75.2 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.351 0.661 . . . . 0.0 110.981 178.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -64.45 -42.15 96.14 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.99 176.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.0 mtp -64.47 -35.94 82.58 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.182 0.901 . . . . 0.0 112.136 173.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.18 -41.79 94.28 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.465 -1.397 . . . . 0.0 112.605 173.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.4 t -63.75 -16.15 60.43 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.45 1.1 . . . . 0.0 113.632 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -113.55 15.28 19.01 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 70.83 37.14 1.38 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.393 1.477 . . . . 0.0 113.389 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -121.62 -33.48 3.6 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.124 1.37 . . . . 0.0 113.62 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.8 mp -118.73 161.76 19.58 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.623 1.169 . . . . 0.0 112.53 172.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -144.58 120.49 10.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.441 1.496 . . . . 0.0 110.374 172.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.9 ttp -87.84 144.44 26.59 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.193 -0.942 . . . . 0.0 112.111 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.71 126.17 41.69 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 125.414 1.486 . . . . 0.0 109.977 173.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -74.0 -4.11 33.33 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 124.702 1.201 . . . . 0.0 113.629 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.7 -33.91 15.6 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.552 1.141 . . . . 0.0 112.817 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.5 t -141.26 10.19 2.1 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.855 1.262 . . . . 0.0 113.225 -178.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 51.04 38.12 19.74 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 127.189 2.196 . . . . 0.0 113.584 -169.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.01 117.79 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.995 -176.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.56 121.53 26.43 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.391 1.076 . . . . 0.0 110.459 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.2 164.41 13.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.89 2.076 . . . . 0.0 108.754 171.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.61 126.92 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 124.154 0.982 . . . . 0.0 108.516 169.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -64.0 88.81 0.05 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.576 1.551 . . . . 0.0 112.02 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.269 0 C-N-CA 127.987 2.515 . . . . 0.0 113.203 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 118.39 -0.814 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -55.11 -46.67 75.59 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.099 0.863 . . . . 0.0 112.122 175.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -55.46 -51.92 65.35 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.344 1.058 . . . . 0.0 113.264 173.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -37.38 83.23 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.232 -0.917 . . . . 0.0 112.504 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 33.9 mt -56.86 -49.5 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.858 0.863 . . . . 0.0 110.59 178.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -62.83 -52.35 63.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.279 0.632 . . . . 0.0 110.658 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -57.74 -42.87 84.81 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.302 1.441 . . . . 0.0 113.184 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -60.11 -54.44 45.84 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.535 1.134 . . . . 0.0 111.375 173.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.7 mt -71.0 -19.18 62.55 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.668 -1.27 . . . . 0.0 113.079 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -72.55 -37.55 68.24 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.36 1.064 . . . . 0.0 110.803 169.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.21 -39.79 22.62 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.221 0.609 . . . . 0.0 112.312 -172.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.62 -29.15 12.84 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 177.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.25 -169.17 24.83 Favored Glycine 0 N--CA 1.47 0.91 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -171.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -64.24 128.97 22.84 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.007 3.138 . . . . 0.0 114.122 -170.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -140.63 163.41 32.95 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.535 1.534 . . . . 0.0 110.762 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -80.43 161.98 24.66 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.137 -1.602 . . . . 0.0 112.401 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.9 -32.11 63.46 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.481 0.712 . . . . 0.0 112.545 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.77 -41.72 91.71 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.96 -0.463 . . . . 0.0 111.412 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.47 -45.39 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 122.906 0.482 . . . . 0.0 109.882 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.8 mm -62.44 -43.53 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.869 0.868 . . . . 0.0 110.468 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.52 -54.68 42.95 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.708 1.203 . . . . 0.0 109.989 -177.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.62 0.768 . . . . 0.0 111.971 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.86 -25.75 64.8 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.2 mt -89.45 -11.94 41.59 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.179 1.391 . . . . 0.0 113.192 170.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.9 6.73 63.28 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.226 1.393 . . . . 0.0 114.129 -177.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.7 mmt -77.76 172.54 13.27 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.281 1.432 . . . . 0.0 110.292 171.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -108.21 -30.33 8.43 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -135.1 156.75 48.49 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.742 1.217 . . . . 0.0 112.062 -174.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.43 -28.73 67.21 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -66.16 -29.38 69.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.894 1.278 . . . . 0.0 113.702 175.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.53 -26.78 67.31 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.641 0.257 . . . . 0.0 111.14 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.32 -31.11 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.598 0.759 . . . . 0.0 112.427 -175.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.18 -40.75 7.49 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.522 1.529 . . . . 0.0 113.066 -176.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -44.69 77.67 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.736 1.214 . . . . 0.0 113.021 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.49 -41.95 59.84 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.286 1.034 . . . . 0.0 111.828 175.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.44 -52.05 66.16 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.695 0.798 . . . . 0.0 112.463 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.75 -32.89 74.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.476 0.71 . . . . 0.0 111.241 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -70.28 -33.49 71.65 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.242 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 94.2 mtp -72.09 -34.29 68.54 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.598 1.159 . . . . 0.0 111.873 170.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -63.05 -42.09 99.63 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 120.424 -1.423 . . . . 0.0 112.411 172.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.5 m -67.17 -14.67 63.13 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -114.13 13.77 18.11 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.84 1.793 . . . . 0.0 115.84 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.48 38.02 0.85 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.44 1.496 . . . . 0.0 113.269 178.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.2 mp -119.8 -32.09 4.34 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.086 1.354 . . . . 0.0 113.275 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.9 mt -126.94 164.44 21.47 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.128 0.971 . . . . 0.0 113.13 175.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -149.37 121.93 8.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.653 1.981 . . . . 0.0 109.197 174.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.5 ttp -90.22 144.73 25.59 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.191 -0.943 . . . . 0.0 112.063 173.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.12 126.01 42.0 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.126 1.37 . . . . 0.0 110.26 174.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.25 -6.52 43.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.114 0.966 . . . . 0.0 113.181 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -87.29 -34.78 18.78 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.441 1.096 . . . . 0.0 113.117 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.4 t -141.31 10.4 2.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.827 1.251 . . . . 0.0 113.176 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 51.37 38.87 22.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 127.061 2.145 . . . . 0.0 113.521 -169.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.83 119.1 26.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.374 0.67 . . . . 0.0 109.962 -175.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -83.51 119.96 25.34 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.518 1.127 . . . . 0.0 110.652 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.97 135.13 54.34 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.969 1.707 . . . . 0.0 108.915 175.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -55.38 130.04 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 120.57 -1.331 . . . . 0.0 109.622 169.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -67.37 86.8 0.18 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.959 1.303 . . . . 0.0 112.36 -177.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 60.8 ttp85 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.178 2.991 . . . . 0.0 113.552 -178.344 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.85 -44.81 96.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.068 0.947 . . . . 0.0 111.279 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.53 -46.58 82.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.654 0.781 . . . . 0.0 111.864 174.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.37 -44.95 92.66 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.649 0.78 . . . . 0.0 112.317 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 49.1 mt -58.65 -50.32 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.537 1.135 . . . . 0.0 111.12 178.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -64.77 -50.28 67.44 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.296 0.639 . . . . 0.0 110.821 -178.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -57.33 -45.95 83.77 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.727 1.211 . . . . 0.0 112.245 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -58.12 -53.99 52.02 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.093 0.957 . . . . 0.0 111.433 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.7 mt -70.48 -18.9 62.97 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.82 -1.175 . . . . 0.0 113.193 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -74.35 -36.12 63.59 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.557 0.743 . . . . 0.0 111.415 169.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -82.26 -38.67 24.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.528 0.731 . . . . 0.0 112.234 -173.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -28.62 12.7 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.42 -168.58 24.22 Favored Glycine 0 N--CA 1.469 0.898 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -172.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -62.49 127.88 22.05 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 124.066 3.177 . . . . 0.0 113.983 -171.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -141.28 163.12 33.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.205 1.402 . . . . 0.0 111.144 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 51.6 mtt85 -81.08 160.09 24.56 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.253 -1.529 . . . . 0.0 111.924 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.03 -31.82 63.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.138 0.575 . . . . 0.0 112.412 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.9 tp -64.83 -41.93 95.35 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.946 -0.471 . . . . 0.0 111.401 176.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.68 -45.34 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.096 0.558 . . . . 0.0 109.679 174.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.7 mm -62.64 -44.19 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 110.408 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.56 -54.76 40.01 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.105 1.362 . . . . 0.0 110.096 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -64.0 -34.34 77.77 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.381 0.672 . . . . 0.0 112.102 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.17 -25.18 64.23 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.8 mt -88.94 -12.0 42.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.378 1.471 . . . . 0.0 113.157 169.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.86 11.0 59.47 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.838 1.209 . . . . 0.0 114.119 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.1 mmt -83.43 176.3 9.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.964 1.706 . . . . 0.0 110.817 172.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -105.88 -38.81 6.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -171.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.7 p -130.45 156.37 44.87 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.459 1.103 . . . . 0.0 112.504 -169.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -28.2 63.82 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.42 1.088 . . . . 0.0 113.802 175.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -69.3 -25.37 64.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.889 1.276 . . . . 0.0 113.797 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.29 -27.95 66.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.12 0.486 . . . . 0.0 111.095 176.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.67 -31.25 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.539 0.736 . . . . 0.0 112.531 -173.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.2 -41.45 8.29 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.048 1.739 . . . . 0.0 112.485 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -54.39 -43.55 71.51 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.581 1.152 . . . . 0.0 113.34 175.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.34 -45.32 32.67 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.548 0.739 . . . . 0.0 111.384 175.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.37 -52.04 66.98 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.326 1.05 . . . . 0.0 112.662 -177.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -36.15 82.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.629 0.772 . . . . 0.0 110.779 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -68.09 -37.38 81.14 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.771 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.7 mtp -67.41 -34.65 77.69 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.944 0.898 . . . . 0.0 111.19 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -61.9 -46.04 91.11 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 113.136 171.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 59.9 m -63.74 -16.04 60.11 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 4.5 ptp85 -113.82 16.24 18.48 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 176.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.3 t60 71.42 37.92 1.09 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.863 1.265 . . . . 0.0 113.241 175.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -118.84 -33.4 4.23 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.767 1.627 . . . . 0.0 112.674 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mt -128.31 164.33 22.85 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -150.87 116.51 5.46 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.115 1.766 . . . . 0.0 109.771 176.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 47.2 ttp -85.79 144.57 27.67 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.713 -0.617 . . . . 0.0 111.943 174.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.05 125.83 38.91 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.514 1.526 . . . . 0.0 108.977 170.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.0 -8.15 54.41 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.005 -1.059 . . . . 0.0 112.885 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -84.44 -35.66 22.88 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.866 1.266 . . . . 0.0 112.835 -171.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -139.46 14.25 2.56 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.032 0.933 . . . . 0.0 112.955 172.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt 54.01 41.18 32.13 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 127.156 2.182 . . . . 0.0 113.134 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.17 119.79 25.95 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.558 0.743 . . . . 0.0 109.863 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -83.59 124.61 30.96 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.964 1.306 . . . . 0.0 110.69 173.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.4 p -129.34 127.34 40.88 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.379 1.471 . . . . 0.0 107.8 -174.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.0 130.3 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.58 -1.325 . . . . 0.0 110.451 178.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -67.74 86.83 0.22 Allowed 'General case' 0 CA--C 1.547 0.828 0 CA-C-O 122.657 1.218 . . . . 0.0 112.032 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 . . . . . 0 C--O 1.253 1.285 0 C-N-CA 128.139 2.576 . . . . 0.0 111.85 -175.176 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -58.62 -49.07 78.85 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.115 0.87 . . . . 0.0 111.01 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.56 -46.43 86.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.005 0.522 . . . . 0.0 112.058 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.4 -42.62 98.79 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 41.8 mt -58.27 -49.73 80.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 C-N-CA 124.612 1.165 . . . . 0.0 110.814 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -61.76 -51.66 67.42 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.013 0.925 . . . . 0.0 111.263 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.3 ttp85 -61.27 -42.47 98.7 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.53 1.532 . . . . 0.0 112.377 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.6 -52.11 66.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.701 0.8 . . . . 0.0 111.452 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.4 mt -71.3 -18.43 62.41 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.934 -1.104 . . . . 0.0 112.859 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.0 ttmt -69.96 -36.23 75.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.939 0.896 . . . . 0.0 110.386 169.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.28 -39.91 27.9 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -174.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -111.22 -21.04 12.1 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 86.85 -165.5 36.51 Favored Glycine 0 N--CA 1.476 1.34 0 CA-C-O 117.987 -1.451 . . . . 0.0 111.281 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -54.48 120.82 8.67 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.871 3.047 . . . . 0.0 114.531 -171.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -135.41 157.04 47.89 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.473 1.509 . . . . 0.0 110.175 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -76.63 162.21 27.92 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 119.932 -1.73 . . . . 0.0 111.867 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . 0.407 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.84 -30.97 62.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.169 0.588 . . . . 0.0 112.139 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.15 -42.5 93.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.792 -0.568 . . . . 0.0 111.288 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 36.3 t -59.3 -45.7 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.059 0.544 . . . . 0.0 109.669 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.407 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -62.61 -44.14 99.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.859 0.864 . . . . 0.0 110.294 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -54.99 -54.58 41.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.291 1.436 . . . . 0.0 109.954 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -64.53 -34.33 77.99 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.126 0.571 . . . . 0.0 112.036 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.83 -24.67 64.4 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.638 0.775 . . . . 0.0 113.041 177.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.6 mt -90.04 -11.93 40.03 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.66 1.584 . . . . 0.0 113.533 169.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.82 10.82 61.08 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.736 1.16 . . . . 0.0 114.345 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.41 175.78 9.58 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.928 1.691 . . . . 0.0 110.76 172.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -107.74 -34.92 6.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -170.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.2 p -131.95 155.99 46.96 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.541 1.136 . . . . 0.0 112.308 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.04 -28.33 64.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.517 1.127 . . . . 0.0 113.688 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.33 -25.49 64.23 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.878 1.271 . . . . 0.0 113.734 176.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -68.27 -27.43 66.32 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.283 0.492 . . . . 0.0 110.941 177.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.42 -31.22 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 123.592 0.757 . . . . 0.0 112.655 -173.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.28 -41.64 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.636 1.575 . . . . 0.0 112.741 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -41.14 69.96 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.803 1.241 . . . . 0.0 113.423 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -79.77 -41.49 26.45 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.2 1.0 . . . . 0.0 112.147 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.07 -52.79 63.42 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.591 0.756 . . . . 0.0 112.226 -178.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -34.19 77.67 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.744 0.818 . . . . 0.0 111.204 178.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 16.1 mtp-105 -60.19 -46.41 89.81 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.636 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 33.9 mtp -66.95 -35.13 79.29 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.057 0.943 . . . . 0.0 111.793 178.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -65.33 -38.31 89.74 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.667 -1.27 . . . . 0.0 113.121 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.5 m -72.1 -14.55 61.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.213 1.005 . . . . 0.0 113.574 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -113.92 13.48 18.33 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 178.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 73.26 36.71 0.8 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.882 1.673 . . . . 0.0 114.148 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.7 mp -121.38 -32.08 3.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.069 1.348 . . . . 0.0 113.668 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.7 mt -124.34 164.01 20.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.453 1.101 . . . . 0.0 113.036 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -148.42 115.42 6.1 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.348 1.859 . . . . 0.0 108.82 179.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.5 ttp -87.67 141.41 28.63 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.379 -0.826 . . . . 0.0 111.587 172.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.84 126.68 37.02 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 124.713 1.205 . . . . 0.0 110.066 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -71.48 -7.12 45.42 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 124.273 1.029 . . . . 0.0 113.19 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -90.22 -33.88 16.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.595 1.158 . . . . 0.0 112.882 -173.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.2 t -142.0 11.26 1.99 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.99 1.316 . . . . 0.0 113.127 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 51.29 37.77 19.64 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 127.361 2.264 . . . . 0.0 114.106 -171.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -89.59 116.88 28.06 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.602 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -79.2 122.34 26.16 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.044 1.337 . . . . 0.0 111.294 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.4 t -132.18 144.43 50.66 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.809 1.643 . . . . 0.0 112.914 171.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -55.73 125.79 11.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 126.088 1.755 . . . . 0.0 111.29 179.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -65.1 89.42 0.08 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.503 1.521 . . . . 0.0 112.829 -177.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 77.0 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 128.301 2.64 . . . . 0.0 112.279 171.346 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.9 -42.99 90.88 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 110.882 177.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.11 -50.92 68.61 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.415 1.086 . . . . 0.0 112.552 175.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -38.34 90.24 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.619 -0.705 . . . . 0.0 112.525 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 44.1 mt -58.69 -50.75 78.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 119.248 0.931 . . . . 0.0 110.746 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.36 -51.65 66.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.987 0.115 . . . . 0.0 110.749 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -57.38 -43.92 84.01 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.184 1.394 . . . . 0.0 113.07 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -59.16 -54.08 51.06 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.194 0.998 . . . . 0.0 111.286 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -70.93 -19.43 62.58 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.744 -1.222 . . . . 0.0 113.087 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -73.14 -36.89 66.75 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.075 0.95 . . . . 0.0 111.117 169.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -82.42 -39.14 23.03 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.339 0.656 . . . . 0.0 112.27 -172.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.14 -28.1 12.87 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 177.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.71 -168.62 25.14 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -62.41 128.49 23.83 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.993 3.129 . . . . 0.0 114.006 -170.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -139.74 164.25 30.45 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.14 1.376 . . . . 0.0 111.09 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.4 mtt-85 -78.86 157.53 28.31 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 120.432 -1.418 . . . . 0.0 111.119 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -53.81 -32.76 53.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.597 0.759 . . . . 0.0 112.542 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.1 tp -64.9 -41.05 95.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.245 0.618 . . . . 0.0 111.684 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 31.6 t -60.66 -45.43 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.8 mm -61.1 -44.07 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.428 0.691 . . . . 0.0 110.459 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.21 -54.98 38.79 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.131 1.372 . . . . 0.0 110.161 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -64.27 -34.3 77.8 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.275 0.63 . . . . 0.0 111.959 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.71 -24.82 64.53 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.0 mt -90.51 -12.02 38.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.087 1.355 . . . . 0.0 113.301 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.55 11.65 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.129 1.347 . . . . 0.0 114.371 -178.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.3 mmt -84.0 176.13 9.06 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.036 1.734 . . . . 0.0 110.99 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -107.49 -35.64 6.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -171.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.9 p -133.34 157.22 46.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.608 1.163 . . . . 0.0 112.05 -171.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.15 -28.22 66.38 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 176.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.75 -28.95 68.82 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.741 1.216 . . . . 0.0 113.765 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.92 -28.36 68.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.949 0.404 . . . . 0.0 111.116 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.34 -31.19 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.706 0.802 . . . . 0.0 112.239 -174.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.07 -41.22 7.46 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.733 1.613 . . . . 0.0 112.617 -175.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -55.48 -42.86 74.96 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.63 1.172 . . . . 0.0 113.465 176.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -77.24 -43.46 33.42 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.072 0.949 . . . . 0.0 111.562 174.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.6 mt -59.08 -51.92 67.98 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.073 0.949 . . . . 0.0 112.433 -177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -34.71 78.29 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.327 0.651 . . . . 0.0 111.256 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.1 mtt-85 -64.24 -38.77 92.24 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.075 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 91.1 mtp -67.65 -35.49 78.98 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.155 0.982 . . . . 0.0 111.997 174.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -63.3 -38.62 91.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.787 -1.196 . . . . 0.0 113.132 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.3 t -68.96 -18.17 64.04 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -113.84 15.89 18.53 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.812 1.782 . . . . 0.0 115.812 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 72.02 38.43 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.328 1.451 . . . . 0.0 113.395 175.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -120.66 -32.83 3.94 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.978 1.711 . . . . 0.0 113.081 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -128.02 163.7 23.98 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.5 1.045 . . . . 0.0 113.781 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -147.69 115.45 6.4 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.959 2.103 . . . . 0.0 108.969 178.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.9 ttp -88.47 143.87 26.71 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.687 -0.633 . . . . 0.0 111.757 174.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -89.68 130.6 35.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.74 1.216 . . . . 0.0 109.619 170.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.97 -7.57 54.92 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.975 0.91 . . . . 0.0 113.016 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -88.72 -34.16 17.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.33 0.652 . . . . 0.0 112.548 -173.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.21 13.13 1.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.47 1.108 . . . . 0.0 113.78 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt 53.07 38.98 28.77 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 126.227 1.811 . . . . 0.0 113.265 -174.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.65 118.37 23.8 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.589 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -85.2 122.67 29.72 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.456 1.103 . . . . 0.0 110.866 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -127.24 129.44 47.78 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.752 1.621 . . . . 0.0 108.555 -176.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.74 128.86 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 110.813 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -68.27 90.56 0.35 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.792 1.237 . . . . 0.0 112.031 -177.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? . . . . . 0 C--O 1.253 1.286 0 C-N-CA 127.539 2.336 . . . . 0.0 111.346 176.986 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.79 -44.8 93.77 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.164 0.986 . . . . 0.0 110.585 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.88 -49.55 74.41 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.266 1.026 . . . . 0.0 112.45 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.63 -41.35 98.96 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.693 0.797 . . . . 0.0 113.028 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 45.6 mt -60.56 -49.55 83.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 124.231 1.012 . . . . 0.0 110.653 177.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.88 -50.67 69.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.668 0.387 . . . . 0.0 111.098 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -58.17 -44.46 88.0 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.351 1.46 . . . . 0.0 112.807 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -59.06 -53.34 59.46 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.951 0.9 . . . . 0.0 111.385 174.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.9 -18.69 62.66 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.773 -1.204 . . . . 0.0 113.104 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.4 ttmt -73.26 -36.0 66.29 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.69 0.796 . . . . 0.0 110.76 169.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.76 -38.34 21.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.403 0.681 . . . . 0.0 112.318 -171.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.93 -26.62 13.36 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 176.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.87 -167.25 26.68 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -172.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -63.86 128.2 21.43 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.943 3.095 . . . . 0.0 113.936 -170.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.6 mm-40 -139.52 164.65 29.34 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.27 1.428 . . . . 0.0 111.385 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -79.25 157.79 27.71 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.364 -1.46 . . . . 0.0 111.082 177.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.32 -32.74 57.36 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.456 0.702 . . . . 0.0 112.567 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.0 tp -65.98 -39.65 90.53 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.197 0.599 . . . . 0.0 111.887 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 29.6 t -60.9 -45.06 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.7 mm -61.6 -44.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.349 0.66 . . . . 0.0 110.639 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.71 -54.92 38.34 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 125.028 1.331 . . . . 0.0 110.028 -177.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.55 -33.41 75.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.216 0.606 . . . . 0.0 112.067 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.05 -25.16 64.32 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.4 mt -89.5 -12.06 41.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.209 1.404 . . . . 0.0 113.097 169.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.9 9.25 59.85 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 125.174 1.369 . . . . 0.0 114.276 -177.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.7 mmt -83.37 172.72 12.21 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.035 1.734 . . . . 0.0 111.06 174.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -107.96 -28.96 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -169.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.5 p -132.15 152.71 51.12 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.952 1.301 . . . . 0.0 111.739 -171.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.2 -29.77 65.94 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.99 0.916 . . . . 0.0 112.614 171.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -67.54 -23.69 65.46 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 127.231 2.213 . . . . 0.0 114.696 174.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -70.35 -28.65 65.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.792 0.724 . . . . 0.0 110.879 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.79 -31.51 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.276 0.63 . . . . 0.0 112.336 -171.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.42 -40.75 5.71 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.027 1.731 . . . . 0.0 113.021 -176.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -45.5 77.2 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.579 1.152 . . . . 0.0 112.852 175.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.98 -40.95 60.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.231 1.012 . . . . 0.0 112.012 174.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.0 -52.8 62.54 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.557 0.743 . . . . 0.0 112.173 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.04 -34.62 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.68 -0.637 . . . . 0.0 111.343 177.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -57.91 -48.06 81.0 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.45 0.3 . . . . 0.0 110.261 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -64.08 -35.6 81.28 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 124.325 1.05 . . . . 0.0 111.515 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -64.75 -37.12 86.54 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.983 -1.073 . . . . 0.0 113.689 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.1 t -71.55 -18.13 62.27 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -113.73 15.4 18.76 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.408 1.632 . . . . 0.0 115.408 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.64 39.27 0.89 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.502 1.521 . . . . 0.0 113.981 175.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.16 -32.63 3.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.177 1.791 . . . . 0.0 113.099 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mt -128.53 163.81 24.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.641 1.11 . . . . 0.0 113.665 176.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -148.79 115.24 5.89 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.795 2.038 . . . . 0.0 108.959 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -89.62 140.9 29.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.649 0.738 . . . . 0.0 111.76 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -102.05 107.0 17.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 126.259 1.823 . . . . 0.0 107.382 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.4 -8.88 20.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.089 1.356 . . . . 0.0 112.868 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -66.09 -32.83 74.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.68 1.992 . . . . 0.0 112.283 177.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.13 16.7 0.84 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 173.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.1 mptt 50.22 39.93 20.96 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.345 2.258 . . . . 0.0 113.384 -170.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.84 118.27 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.383 0.673 . . . . 0.0 109.866 174.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -83.4 127.05 33.37 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.333 1.453 . . . . 0.0 111.428 173.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -132.81 129.54 38.66 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.859 1.664 . . . . 0.0 108.494 -174.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.39 129.52 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.497 -1.377 . . . . 0.0 111.301 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.1 88.01 0.41 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.046 1.338 . . . . 0.0 112.187 -177.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.845 2.058 . . . . 0.0 113.519 176.455 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -62.32 -45.78 91.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.291 0.567 . . . . 0.0 111.521 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.22 -48.93 75.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.718 0.807 . . . . 0.0 112.459 171.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.8 -46.21 88.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.005 0.922 . . . . 0.0 112.384 175.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 39.9 mt -57.73 -50.09 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 124.585 1.154 . . . . 0.0 110.948 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -65.09 -50.99 63.98 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.026 0.531 . . . . 0.0 110.893 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -56.7 -45.56 81.75 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.522 1.129 . . . . 0.0 111.968 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -58.44 -54.3 48.55 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.138 0.975 . . . . 0.0 111.434 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.4 mt -70.53 -18.9 62.94 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.861 -1.149 . . . . 0.0 113.359 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -74.34 -36.33 63.64 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.829 0.74 . . . . 0.0 111.423 169.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -81.77 -38.63 25.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.418 0.687 . . . . 0.0 112.322 -173.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.98 -29.03 12.78 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.66 -168.85 24.1 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -171.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -63.22 127.81 21.09 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.166 3.244 . . . . 0.0 114.126 -171.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -141.41 162.68 34.89 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.234 1.414 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -79.32 161.38 26.29 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 120.153 -1.592 . . . . 0.0 112.503 178.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . 0.403 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.05 -32.39 64.01 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.244 0.618 . . . . 0.0 112.413 -179.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.6 tp -65.09 -41.58 94.88 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.789 -0.569 . . . . 0.0 111.365 177.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.5 t -59.34 -45.06 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.971 0.508 . . . . 0.0 109.896 174.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.403 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -63.73 -43.0 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.758 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.85 -54.78 40.33 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.13 1.372 . . . . 0.0 110.06 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -63.93 -34.55 78.22 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.251 0.62 . . . . 0.0 111.939 -179.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.46 64.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 177.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.6 mt -88.48 -11.88 44.6 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.567 1.547 . . . . 0.0 113.256 170.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.99 10.86 60.81 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.697 1.141 . . . . 0.0 114.144 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.0 mmt -83.47 175.32 9.89 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.988 1.715 . . . . 0.0 110.859 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -107.8 -34.62 6.9 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -171.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 63.0 p -132.45 156.78 46.12 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.584 1.154 . . . . 0.0 112.181 -171.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.17 66.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 113.732 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.95 -29.73 69.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.913 1.285 . . . . 0.0 113.773 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -67.2 -23.97 65.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.861 0.362 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.77 -30.93 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.98 0.912 . . . . 0.0 112.598 -176.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.89 -40.62 14.4 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.326 1.45 . . . . 0.0 112.747 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -44.34 77.94 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.495 1.118 . . . . 0.0 112.744 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.64 -42.8 60.92 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.807 1.243 . . . . 0.0 111.814 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.2 mt -62.44 -51.52 67.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.981 0.913 . . . . 0.0 112.306 -176.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.68 -34.56 78.13 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.27 0.628 . . . . 0.0 110.792 178.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 83.1 mtt-85 -65.64 -37.26 86.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.492 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.7 mtp -68.83 -34.05 74.85 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.066 0.946 . . . . 0.0 111.874 173.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.5 tttp -64.09 -38.66 91.86 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.581 -1.324 . . . . 0.0 112.803 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.95 -14.61 62.79 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 175.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -114.08 14.83 18.39 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 175.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 72.06 38.51 0.89 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.363 1.465 . . . . 0.0 113.417 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -120.39 -32.86 4.0 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.767 1.627 . . . . 0.0 113.19 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 10.9 mt -128.08 163.44 24.6 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 176.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -150.23 115.37 5.39 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.165 1.786 . . . . 0.0 109.788 177.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 48.9 ttp -84.09 145.97 28.16 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.802 -0.561 . . . . 0.0 111.8 174.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -96.15 127.47 42.19 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 125.239 1.415 . . . . 0.0 109.135 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -71.14 -13.83 62.08 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.178 -0.951 . . . . 0.0 112.377 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -83.82 -37.34 22.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.678 1.191 . . . . 0.0 113.251 -169.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 6.3 t -134.16 8.11 3.71 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.196 1.398 . . . . 0.0 112.629 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm 51.53 40.18 26.38 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 127.053 2.141 . . . . 0.0 113.328 -170.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.31 120.38 28.54 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.612 -177.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -82.09 124.81 30.17 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.528 1.131 . . . . 0.0 110.801 172.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.5 p -130.36 128.0 40.54 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 108.465 -173.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.37 128.62 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 120.466 -1.397 . . . . 0.0 110.9 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -67.43 90.35 0.24 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.797 1.239 . . . . 0.0 111.89 -178.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 126.853 2.061 . . . . 0.0 112.475 179.012 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 . . . . . 0 N--CA 1.474 0.739 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -62.28 -45.69 92.13 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.708 0.803 . . . . 0.0 111.39 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.41 -48.55 76.71 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.912 0.885 . . . . 0.0 112.971 170.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.46 -44.41 95.89 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.061 0.944 . . . . 0.0 112.595 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 32.9 mt -57.97 -49.52 80.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 124.751 1.22 . . . . 0.0 110.799 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -64.28 -50.05 69.43 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.071 0.548 . . . . 0.0 110.711 -177.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -54.58 -51.42 65.34 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.188 0.995 . . . . 0.0 111.971 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -54.56 -52.0 63.45 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 123.851 0.86 . . . . 0.0 111.538 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.32 -19.89 61.58 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.943 -1.098 . . . . 0.0 113.004 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -73.05 -34.27 66.18 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.846 0.858 . . . . 0.0 110.704 169.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.63 -39.0 20.82 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.972 0.909 . . . . 0.0 111.706 -170.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.93 -27.93 11.87 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 176.001 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 98.49 -169.81 23.88 Favored Glycine 0 N--CA 1.474 1.186 0 CA-C-O 118.785 -1.008 . . . . 0.0 110.644 -171.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -61.5 129.53 28.42 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.985 3.124 . . . . 0.0 114.122 -171.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -139.76 164.82 28.94 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.304 1.442 . . . . 0.0 110.785 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.12 158.29 26.42 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.33 -1.481 . . . . 0.0 111.068 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.13 -33.2 57.23 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.445 0.698 . . . . 0.0 112.605 -178.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.88 -39.93 91.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.178 0.591 . . . . 0.0 111.848 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.0 t -60.31 -45.91 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.1 mm -61.05 -43.4 96.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.364 0.665 . . . . 0.0 110.528 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.42 -54.33 48.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.636 1.175 . . . . 0.0 110.077 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -65.28 -33.16 75.32 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.987 0.515 . . . . 0.0 112.061 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.93 -25.71 64.71 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.0 mt -88.6 -11.27 45.97 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.249 1.419 . . . . 0.0 113.319 169.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.84 11.54 61.65 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.762 1.172 . . . . 0.0 114.236 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.2 mtt -80.52 176.21 9.99 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.007 1.723 . . . . 0.0 111.211 171.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -108.14 -35.96 6.43 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.4 p -125.64 152.2 45.5 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.024 1.33 . . . . 0.0 112.312 -170.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.12 -29.09 68.39 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -64.13 -28.58 69.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.935 2.094 . . . . 0.0 114.453 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -72.26 -20.62 61.5 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.822 0.737 . . . . 0.0 111.439 177.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.48 -30.57 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.539 -0.725 . . . . 0.0 112.651 -177.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.07 -40.28 31.06 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.379 1.472 . . . . 0.0 112.389 -173.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -52.38 -50.17 62.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.682 1.193 . . . . 0.0 111.817 173.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -71.15 -41.76 70.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.009 1.324 . . . . 0.0 111.654 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.03 -52.9 61.06 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.109 0.963 . . . . 0.0 111.916 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -33.04 74.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.776 0.83 . . . . 0.0 111.302 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 48.0 mtp85 -61.52 -43.07 99.53 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.923 174.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.1 mtp -69.71 -33.18 72.15 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.997 0.919 . . . . 0.0 111.809 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -62.8 -42.23 99.62 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.488 -1.382 . . . . 0.0 112.408 170.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.9 m -69.18 -13.85 62.65 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 178.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -114.08 14.89 18.39 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 72.77 38.46 0.75 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.361 1.464 . . . . 0.0 113.588 176.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.1 mp -121.51 -31.9 3.94 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.731 1.612 . . . . 0.0 113.368 -178.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 10.0 mt -127.35 164.19 22.34 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -148.38 115.84 6.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.809 1.643 . . . . 0.0 110.259 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -86.15 144.27 27.58 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.343 -0.848 . . . . 0.0 112.034 174.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.37 130.61 34.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.71 1.204 . . . . 0.0 109.236 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -73.82 -9.34 58.55 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 124.679 1.192 . . . . 0.0 112.878 176.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -90.79 -39.1 12.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -174.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.64 15.12 2.34 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.72 40.84 31.11 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 126.162 1.785 . . . . 0.0 113.045 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.42 117.35 23.58 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.47 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.52 122.32 28.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.197 0.999 . . . . 0.0 110.637 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.46 131.17 51.72 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 125.513 1.525 . . . . 0.0 108.434 -178.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -52.23 133.33 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.115 -0.991 . . . . 0.0 110.702 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -70.26 102.12 2.05 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 111.193 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.707 2.003 . . . . 0.0 112.758 173.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 . . . . . 0 N--CA 1.474 0.733 0 CA-C-O 118.698 -0.668 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -53.87 -48.65 69.82 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.873 0.76 . . . . 0.0 112.061 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.56 -51.25 70.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.018 0.927 . . . . 0.0 112.155 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.09 -42.33 99.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 118.589 -0.72 . . . . 0.0 112.262 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 49.5 mt -57.75 -51.31 71.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.66 1.118 . . . . 0.0 111.256 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -65.26 -49.3 70.14 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.124 0.57 . . . . 0.0 110.423 -176.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.7 tpt85 -58.59 -43.86 89.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.559 1.144 . . . . 0.0 112.825 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -60.75 -53.85 52.33 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 124.756 1.222 . . . . 0.0 111.558 175.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.21 -19.54 63.96 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.957 -1.089 . . . . 0.0 112.705 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -73.84 -35.48 64.82 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.729 0.695 . . . . 0.0 111.482 169.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -77.72 -41.37 38.09 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.158 0.583 . . . . 0.0 111.957 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.58 -28.01 11.99 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -178.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.29 -166.7 24.51 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -172.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -62.97 125.91 16.91 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.896 3.064 . . . . 0.0 114.124 -169.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -139.13 162.24 35.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.205 1.402 . . . . 0.0 110.973 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -81.12 160.25 24.48 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.282 -1.511 . . . . 0.0 112.032 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.2 -32.8 62.51 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.6 0.636 . . . . 0.0 112.522 -177.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.7 tp -65.74 -40.87 92.59 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.957 -0.464 . . . . 0.0 111.493 177.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.1 t -59.14 -46.35 92.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.169 0.587 . . . . 0.0 109.638 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.1 mm -62.26 -43.36 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.834 0.853 . . . . 0.0 110.547 -179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -58.06 -53.88 53.23 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.504 1.121 . . . . 0.0 110.185 -178.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.04 -34.31 77.73 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.072 0.549 . . . . 0.0 111.984 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.91 -26.33 65.93 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.422 0.689 . . . . 0.0 112.833 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.1 mt -86.35 -11.94 50.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.658 1.583 . . . . 0.0 113.19 169.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.94 11.15 61.95 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.831 1.205 . . . . 0.0 113.801 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 29.2 mtt -80.86 176.91 9.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.508 1.923 . . . . 0.0 111.228 173.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -108.04 -37.35 6.09 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -176.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -128.29 155.02 45.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.593 1.157 . . . . 0.0 112.52 -170.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.76 -24.94 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.31 1.044 . . . . 0.0 113.464 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.08 -28.91 68.57 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.728 1.211 . . . . 0.0 113.324 174.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -72.77 -15.66 61.65 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 118.383 0.538 . . . . 0.0 112.267 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -108.57 -31.06 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.017 0.927 . . . . 0.0 113.001 178.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.56 -41.11 53.81 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.07 1.348 . . . . 0.0 112.376 -172.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -55.4 -41.58 72.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.212 1.005 . . . . 0.0 112.639 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.51 -46.71 25.43 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.313 1.045 . . . . 0.0 111.49 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 84.2 mt -57.09 -51.94 67.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.493 1.117 . . . . 0.0 112.333 -178.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 -35.13 77.57 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.071 0.548 . . . . 0.0 111.247 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -64.43 -40.51 95.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 118.467 -0.777 . . . . 0.0 110.767 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 87.5 mtp -66.14 -34.8 78.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.673 1.189 . . . . 0.0 111.419 175.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.3 tttm -63.66 -40.28 96.45 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.531 -1.356 . . . . 0.0 113.112 169.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.69 -14.12 62.64 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 175.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -114.11 14.7 18.32 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 176.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.5 t-80 72.11 37.84 0.95 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.531 1.533 . . . . 0.0 113.624 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -120.09 -32.61 4.14 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.657 1.583 . . . . 0.0 113.099 -179.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -127.92 164.08 23.06 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -148.79 115.41 5.94 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.972 2.109 . . . . 0.0 109.178 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.5 ttp -88.8 144.03 26.51 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.569 -0.707 . . . . 0.0 112.147 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.94 129.78 37.83 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.446 1.498 . . . . 0.0 110.102 171.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -74.16 -7.3 52.15 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 123.975 0.91 . . . . 0.0 113.147 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.87 -35.93 21.89 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.657 0.783 . . . . 0.0 112.865 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 2.1 t -144.47 15.77 1.64 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt 54.27 39.44 30.84 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.094 1.757 . . . . 0.0 113.306 -171.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -82.34 119.0 23.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.387 0.675 . . . . 0.0 109.857 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -86.18 123.19 31.19 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.025 1.33 . . . . 0.0 110.601 175.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -126.95 129.03 47.35 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 125.709 1.604 . . . . 0.0 108.083 -176.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.76 129.79 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 120.851 -1.155 . . . . 0.0 110.474 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.51 91.07 0.56 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.432 1.093 . . . . 0.0 111.255 -179.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 126.615 1.966 . . . . 0.0 112.056 177.86 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 111.321 0.119 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -61.36 -49.24 77.75 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.664 1.185 . . . . 0.0 112.389 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.64 -46.7 73.99 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.629 1.172 . . . . 0.0 112.484 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.01 -43.73 94.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.793 173.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 42.0 mt -56.7 -49.66 77.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.679 1.127 . . . . 0.0 111.446 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -64.14 -53.17 53.78 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.017 0.527 . . . . 0.0 110.61 -177.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.2 ttp85 -57.75 -42.61 84.32 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.862 1.265 . . . . 0.0 113.019 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -58.95 -54.03 51.73 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.288 1.035 . . . . 0.0 111.462 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.55 -18.81 62.92 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.75 -1.219 . . . . 0.0 113.137 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -73.04 -35.01 66.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 110.924 169.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.34 -39.26 17.85 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.405 0.682 . . . . 0.0 112.438 -172.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.59 -26.44 13.83 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.82 -167.4 26.85 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -173.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -62.49 126.23 17.94 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.947 3.098 . . . . 0.0 113.821 -170.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -139.33 162.6 34.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.035 1.334 . . . . 0.0 110.857 179.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 54.3 mtt85 -80.69 159.75 25.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.36 -1.463 . . . . 0.0 111.955 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.72 -33.11 60.63 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.35 0.66 . . . . 0.0 112.552 -177.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.01 -41.9 94.94 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.971 -0.456 . . . . 0.0 111.582 177.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.0 -45.78 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.238 0.615 . . . . 0.0 109.691 174.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 mm -61.92 -44.29 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 123.783 0.833 . . . . 0.0 110.344 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.8 -54.39 46.96 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.924 1.29 . . . . 0.0 110.194 -177.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -63.47 -34.44 77.76 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.357 0.663 . . . . 0.0 112.007 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.37 -24.73 63.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.3 mt -88.9 -11.83 43.45 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.642 1.577 . . . . 0.0 113.428 170.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.54 11.3 58.33 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.106 1.336 . . . . 0.0 113.991 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 30.5 mtt -81.33 177.03 9.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 111.29 173.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.94 -36.6 6.31 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 64.2 p -131.54 155.79 46.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.736 1.214 . . . . 0.0 112.572 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.57 -28.6 67.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.469 1.108 . . . . 0.0 113.523 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -66.09 -28.39 68.78 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 113.197 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -73.46 -15.34 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -108.11 -30.83 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.532 1.133 . . . . 0.0 113.192 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.95 -40.71 31.41 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.283 1.433 . . . . 0.0 112.406 -173.083 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -54.82 -40.86 70.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.511 1.124 . . . . 0.0 112.989 175.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -77.23 -46.46 23.14 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 176.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.48 -51.77 68.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.394 1.077 . . . . 0.0 112.127 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -33.14 74.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.636 0.774 . . . . 0.0 111.621 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.3 mtp-105 -70.17 -32.28 70.15 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.963 -0.46 . . . . 0.0 112.152 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -73.68 -34.09 64.72 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.663 1.185 . . . . 0.0 111.458 171.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -62.67 -42.52 99.66 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.236 -1.54 . . . . 0.0 112.047 171.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.1 m -67.05 -13.58 62.06 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -113.97 14.93 18.54 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 176.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.03 38.4 0.91 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.667 1.587 . . . . 0.0 112.94 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 5.4 mp -121.52 -32.48 3.82 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.636 1.174 . . . . 0.0 113.752 -179.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -123.89 164.65 18.84 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.158 0.983 . . . . 0.0 113.227 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.2 115.38 5.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.799 2.04 . . . . 0.0 108.854 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.1 ttp -88.43 143.52 26.94 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.708 -0.62 . . . . 0.0 111.9 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -90.21 130.77 36.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.018 1.327 . . . . 0.0 109.841 171.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.65 -9.12 58.34 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 123.899 0.88 . . . . 0.0 113.014 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -86.45 -36.46 19.07 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -172.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.9 t -143.09 15.86 1.9 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.049 0.94 . . . . 0.0 113.488 176.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 54.0 40.6 31.77 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.12 1.768 . . . . 0.0 113.307 -172.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.92 119.96 25.52 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.591 0.757 . . . . 0.0 109.875 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -86.09 123.82 31.82 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.06 1.344 . . . . 0.0 110.824 174.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -128.33 130.24 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.706 1.602 . . . . 0.0 108.743 -175.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.81 126.43 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 120.756 -1.215 . . . . 0.0 110.598 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.89 95.62 0.26 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.146 . . . . 0.0 112.48 -177.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.199 2.6 . . . . 0.0 113.559 171.192 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.3 m . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -96.93 -14.49 21.7 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -177.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 84.3 mtp -90.69 165.2 13.83 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.932 1.293 . . . . 0.0 112.371 177.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.31 150.14 43.99 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.114 0.966 . . . . 0.0 112.917 177.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.7 p -84.73 -32.3 0.48 Allowed Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 117.793 2.516 . . . . 0.0 117.793 -170.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -83.62 165.98 13.78 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 CA-C-N 123.287 2.21 . . . . 0.0 112.427 -175.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.3 mm100 -124.24 117.0 23.58 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.296 1.838 . . . . 0.0 110.924 176.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -105.99 143.17 34.51 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.245 1.018 . . . . 0.0 111.861 171.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 74.5 m -88.02 -30.63 19.82 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.173 1.389 . . . . 0.0 112.961 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -155.19 168.3 27.51 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.77 1.228 . . . . 0.0 112.298 -172.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -52.98 -35.83 59.61 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.856 1.262 . . . . 0.0 113.005 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 48.6 mtt180 -60.88 -53.92 51.39 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.437 1.017 . . . . 0.0 111.684 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -59.43 -45.65 90.98 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.72 1.208 . . . . 0.0 111.839 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -58.3 -43.61 88.18 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.452 1.101 . . . . 0.0 112.786 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.67 -42.74 86.09 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.207 -0.933 . . . . 0.0 112.944 173.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 27.3 mt -55.52 -49.28 74.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.44 -53.56 50.39 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.176 0.59 . . . . 0.0 110.752 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -56.01 -44.36 78.6 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.967 1.307 . . . . 0.0 113.493 178.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -58.89 -54.22 49.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.389 1.076 . . . . 0.0 111.237 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.87 -18.96 62.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.821 -1.174 . . . . 0.0 113.187 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -73.36 -36.26 66.08 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.812 0.845 . . . . 0.0 111.294 169.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.46 -39.24 20.79 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.412 0.685 . . . . 0.0 112.408 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.05 -28.39 13.08 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.93 -168.74 24.91 Favored Glycine 0 N--CA 1.469 0.9 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 -172.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -62.96 128.26 22.56 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 124.004 3.136 . . . . 0.0 113.842 -170.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -139.97 163.17 33.39 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.07 1.348 . . . . 0.0 111.053 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -80.5 159.29 25.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.364 -1.46 . . . . 0.0 111.51 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.58 -33.52 60.41 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.558 0.743 . . . . 0.0 112.505 -177.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.25 -41.05 94.68 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.265 0.626 . . . . 0.0 111.627 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.6 t -59.44 -45.82 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.431 0.692 . . . . 0.0 109.154 174.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 mm -61.99 -43.26 97.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.492 0.717 . . . . 0.0 110.67 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.46 -54.54 45.63 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.718 1.207 . . . . 0.0 110.044 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -63.87 -34.61 78.32 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.325 0.65 . . . . 0.0 111.974 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.67 -25.39 64.78 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.7 mt -89.36 -11.98 41.76 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.475 1.51 . . . . 0.0 113.437 170.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.7 11.46 59.17 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.674 1.13 . . . . 0.0 114.204 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.1 mtt -80.08 176.88 9.35 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.043 1.737 . . . . 0.0 110.982 171.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -107.96 -38.14 5.89 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -175.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 60.0 p -129.33 155.75 45.12 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.347 -170.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.52 -28.07 66.74 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.53 -27.6 67.11 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.77 1.228 . . . . 0.0 113.472 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.17 -22.47 62.96 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.301 0.5 . . . . 0.0 111.457 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.25 -30.31 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 O-C-N 121.634 -0.667 . . . . 0.0 112.693 -177.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.41 -39.51 32.96 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.265 1.426 . . . . 0.0 112.498 -172.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -53.49 -49.82 66.69 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.272 1.029 . . . . 0.0 111.823 173.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -70.37 -42.25 72.05 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.006 1.322 . . . . 0.0 111.666 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.93 -52.87 61.37 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.843 0.857 . . . . 0.0 111.983 -177.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -33.23 75.01 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.433 0.693 . . . . 0.0 111.087 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.4 mtp85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.053 0.388 . . . . 0.0 110.887 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.94 -32.73 71.15 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.157 0.983 . . . . 0.0 111.939 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -64.45 -39.43 93.8 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.464 -1.398 . . . . 0.0 112.918 169.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.5 t -68.35 -14.37 62.94 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -115.53 15.99 16.61 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 115.853 1.797 . . . . 0.0 115.853 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.85 38.51 0.93 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.465 1.506 . . . . 0.0 113.162 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 6.6 mp -121.22 -32.26 3.93 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.507 1.523 . . . . 0.0 113.391 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mt -126.8 163.42 23.61 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.163 0.892 . . . . 0.0 113.057 175.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -148.35 117.45 6.82 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.007 1.723 . . . . 0.0 109.187 176.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -85.31 143.03 28.93 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.98 -0.45 . . . . 0.0 111.416 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -87.1 131.04 34.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.966 1.306 . . . . 0.0 109.413 170.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -70.96 -14.59 62.42 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.977 0.911 . . . . 0.0 112.365 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -83.33 -40.79 19.02 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.659 0.783 . . . . 0.0 112.604 -170.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.2 t -138.93 15.21 2.66 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.506 1.122 . . . . 0.0 113.703 178.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 53.1 40.65 31.57 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.404 1.481 . . . . 0.0 112.813 -174.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.52 119.13 24.82 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.453 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -84.68 124.87 31.98 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.59 1.156 . . . . 0.0 110.925 175.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -130.83 129.2 42.05 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.58 1.552 . . . . 0.0 108.542 -174.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.56 127.82 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 120.707 -1.245 . . . . 0.0 110.788 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -66.88 91.65 0.21 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.771 1.228 . . . . 0.0 112.41 -176.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 . . . . . 0 C--O 1.255 1.358 0 C-N-CA 128.484 2.713 . . . . 0.0 113.379 176.146 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.507 ' CG ' ' H ' ' A' ' 100' ' ' MET . 19.3 t-80 -134.4 -171.09 2.67 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.193 1.397 . . . . 0.0 111.688 177.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.507 ' H ' ' CG ' ' A' ' 99' ' ' HIS . 66.2 mtt -66.65 153.51 42.93 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.479 1.512 . . . . 0.0 113.211 -174.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.28 20.86 2.61 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.38 1.472 . . . . 0.0 113.88 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 45.3 m -156.08 153.42 25.52 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 126.238 1.815 . . . . 0.0 110.888 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -74.97 175.54 11.09 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.563 2.842 . . . . 0.0 113.158 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -123.56 112.79 17.87 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.271 1.828 . . . . 0.0 108.332 169.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -79.33 148.64 32.0 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -169.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 6.2 t -76.88 -34.37 57.77 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 176.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -150.74 166.64 29.8 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -45.14 -44.78 10.92 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 126.569 1.948 . . . . 0.0 113.26 176.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -62.64 -40.08 95.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -64.59 -42.71 95.42 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.173 0.989 . . . . 0.0 110.311 -177.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -62.53 -49.4 75.5 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.953 0.901 . . . . 0.0 112.002 171.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.54 -45.95 84.47 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.822 0.849 . . . . 0.0 112.52 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 29.3 mt -59.84 -50.18 81.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.213 1.005 . . . . 0.0 110.86 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -64.71 -48.33 75.05 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.842 0.457 . . . . 0.0 110.813 -177.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.4 tpt85 -58.7 -44.58 90.36 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.924 1.29 . . . . 0.0 112.773 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.93 -52.99 62.7 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.678 1.191 . . . . 0.0 111.55 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.77 -19.33 63.51 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.99 -1.069 . . . . 0.0 112.648 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -72.89 -34.74 66.87 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.443 0.697 . . . . 0.0 110.82 169.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.81 -41.38 26.57 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.216 0.607 . . . . 0.0 112.098 -173.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -27.95 12.37 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.41 -167.43 24.78 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.316 -1.113 . . . . 0.0 110.316 -171.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -64.86 127.74 19.3 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.68 2.92 . . . . 0.0 114.322 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -139.42 163.25 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.446 1.499 . . . . 0.0 110.889 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -81.14 162.31 23.72 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 120.172 -1.58 . . . . 0.0 112.46 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.05 -32.04 63.7 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.364 0.666 . . . . 0.0 112.649 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.55 -41.14 89.11 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.939 -0.475 . . . . 0.0 111.41 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.86 -45.38 91.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.976 0.511 . . . . 0.0 109.768 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.9 mm -64.0 -42.65 96.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.629 0.772 . . . . 0.0 110.686 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.96 -54.44 44.79 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.713 1.205 . . . . 0.0 110.002 -178.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -64.28 -33.85 76.77 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.222 0.609 . . . . 0.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.74 -24.77 63.59 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.094 0.775 . . . . 0.0 113.094 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.2 mt -89.66 -11.94 41.03 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.351 1.46 . . . . 0.0 113.118 169.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.93 11.05 60.68 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.781 1.181 . . . . 0.0 114.136 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.06 174.98 10.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.915 1.686 . . . . 0.0 110.803 172.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -107.79 -33.97 7.1 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.3 p -133.42 156.25 48.04 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.587 1.155 . . . . 0.0 112.239 -171.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.13 -27.94 66.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.376 1.07 . . . . 0.0 113.581 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.46 -26.38 65.47 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.982 1.313 . . . . 0.0 113.702 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -69.04 -24.1 64.14 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.424 0.556 . . . . 0.0 111.345 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.25 -30.95 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 123.868 0.867 . . . . 0.0 112.659 -174.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.99 -41.1 15.71 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 125.325 1.45 . . . . 0.0 112.408 -175.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.17 -44.08 71.18 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.541 1.137 . . . . 0.0 112.9 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.02 -43.17 55.24 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.628 1.171 . . . . 0.0 112.135 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -62.45 -51.81 66.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.72 0.808 . . . . 0.0 112.313 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -34.4 77.59 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.669 0.788 . . . . 0.0 110.903 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 2.4 mtm105 -61.39 -44.16 97.62 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.007 0.367 . . . . 0.0 110.595 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.76 -34.56 78.61 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.907 0.883 . . . . 0.0 111.394 177.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -65.29 -37.64 87.77 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.849 -1.157 . . . . 0.0 113.503 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.67 -18.52 63.57 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -113.72 15.71 18.71 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.32 39.22 0.96 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.451 1.501 . . . . 0.0 113.965 174.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.96 -32.11 3.79 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.228 1.811 . . . . 0.0 113.246 -178.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.7 mt -129.31 164.28 23.87 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.417 1.008 . . . . 0.0 113.47 176.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -148.85 118.23 6.9 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.52 1.928 . . . . 0.0 109.505 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -87.67 142.48 27.8 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.964 -1.085 . . . . 0.0 112.154 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.01 116.12 31.39 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 126.193 1.797 . . . . 0.0 108.001 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.42 -6.92 39.17 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.916 0.887 . . . . 0.0 112.693 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.7 mp0 -69.44 -33.78 73.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.407 1.883 . . . . 0.0 112.444 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 4.4 t -148.83 14.53 0.93 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.059 1.344 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 51.35 35.88 14.99 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 127.68 2.392 . . . . 0.0 113.28 -169.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.45 119.55 25.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.677 0.791 . . . . 0.0 110.35 -174.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -82.3 121.75 27.06 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.926 1.29 . . . . 0.0 111.091 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.75 133.6 54.92 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.164 1.786 . . . . 0.0 109.506 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.35 127.41 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.451 -1.406 . . . . 0.0 110.476 174.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.43 92.75 0.21 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.646 1.179 . . . . 0.0 111.838 -177.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.274 0 C-N-CA 127.539 2.336 . . . . 0.0 112.001 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.4 m . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.0 p-80 -143.1 172.65 12.43 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.226 -178.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 77.7 mtm -123.95 149.58 45.78 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.192 1.397 . . . . 0.0 111.806 177.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.47 51.74 2.31 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.192 1.397 . . . . 0.0 113.247 -173.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 22.6 t -145.75 135.83 11.87 Favored Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 125.15 1.38 . . . . 0.0 111.191 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -78.36 169.79 19.52 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.539 2.826 . . . . 0.0 113.041 -177.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -124.26 110.27 14.42 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.263 1.825 . . . . 0.0 109.167 169.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -76.31 140.5 41.52 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -172.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 4.0 m -76.85 -31.81 57.11 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.709 0.803 . . . . 0.0 112.874 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -153.31 166.84 31.34 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.346 1.858 . . . . 0.0 110.349 175.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.82 -27.95 69.67 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -172.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -59.61 -41.33 90.12 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.873 0.761 . . . . 0.0 112.192 171.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -64.27 -39.13 93.3 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.777 0.831 . . . . 0.0 109.699 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -65.15 -51.7 59.58 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.972 0.509 . . . . 0.0 111.909 169.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.27 88.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.698 0.681 . . . . 0.0 111.891 -178.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 30.2 mt -58.34 -53.47 45.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.174 0.99 . . . . 0.0 110.643 175.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -61.42 -48.66 80.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.876 0.369 . . . . 0.0 111.256 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -64.32 -42.88 96.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.572 1.549 . . . . 0.0 112.427 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -60.57 -45.04 95.39 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.793 0.837 . . . . 0.0 112.4 174.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 82.7 mt -75.25 -25.5 58.11 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 121.355 -0.841 . . . . 0.0 112.725 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -69.12 -40.88 78.04 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.275 1.03 . . . . 0.0 110.4 169.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -75.39 -42.37 53.97 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -109.33 -16.98 13.91 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -173.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 100.89 -168.32 20.26 Favored Glycine 0 N--CA 1.466 0.67 0 C-N-CA 125.101 1.334 . . . . 0.0 110.557 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -63.09 127.37 20.07 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.757 2.305 . . . . 0.0 112.004 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -136.77 163.35 30.83 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.686 1.194 . . . . 0.0 110.712 176.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.4 mtt85 -80.79 160.48 24.85 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 120.194 -1.566 . . . . 0.0 111.726 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.94 -31.99 63.42 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -176.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.5 tp -65.62 -42.06 92.0 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.709 0.404 . . . . 0.0 111.31 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.27 -45.18 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.07 0.548 . . . . 0.0 109.575 174.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.9 mm -63.38 -42.22 95.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 123.603 0.761 . . . . 0.0 110.542 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.44 -54.27 45.85 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.601 1.16 . . . . 0.0 109.827 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -65.64 -33.5 76.05 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.051 0.54 . . . . 0.0 112.138 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.27 -24.41 64.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.674 0.789 . . . . 0.0 112.87 176.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.2 mt -90.96 -11.96 37.4 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.064 1.745 . . . . 0.0 113.472 170.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.16 10.88 61.94 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.696 1.141 . . . . 0.0 114.307 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.24 175.72 9.7 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.017 1.727 . . . . 0.0 110.807 172.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -106.48 -35.01 7.21 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -134.16 156.99 47.35 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.431 1.092 . . . . 0.0 112.445 -170.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.5 -27.32 64.35 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.423 1.089 . . . . 0.0 113.7 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.42 -22.57 61.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.679 1.591 . . . . 0.0 114.129 176.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -70.86 -25.83 62.99 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.693 0.678 . . . . 0.0 111.14 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -104.85 -31.47 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.986 0.914 . . . . 0.0 112.692 -173.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -46.71 -38.23 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.559 1.544 . . . . 0.0 113.224 -175.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.38 -50.07 70.69 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.284 1.433 . . . . 0.0 112.107 174.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -70.1 -41.29 74.22 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.828 1.251 . . . . 0.0 111.601 176.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.07 -53.35 51.16 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.332 0.653 . . . . 0.0 112.276 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.4 -31.72 72.13 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.647 0.779 . . . . 0.0 111.106 177.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -60.16 -47.77 84.55 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.184 0.447 . . . . 0.0 110.489 172.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.3 mtp -64.9 -34.32 78.12 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.198 0.999 . . . . 0.0 111.368 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -63.77 -40.57 97.01 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.868 -1.145 . . . . 0.0 113.038 170.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.5 m -72.24 -13.74 61.6 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -113.91 14.98 18.62 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 174.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 72.02 39.21 0.83 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.541 1.537 . . . . 0.0 114.038 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.38 -31.57 3.78 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.118 1.767 . . . . 0.0 113.366 -178.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.5 mt -128.77 163.66 24.7 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.71 1.141 . . . . 0.0 113.967 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -148.08 121.59 9.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.367 1.867 . . . . 0.0 109.424 175.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 46.6 ttp -90.35 145.81 24.67 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.293 -0.88 . . . . 0.0 112.427 173.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -93.23 128.32 39.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.162 1.385 . . . . 0.0 109.053 170.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.64 -14.47 62.49 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 121.19 -0.944 . . . . 0.0 112.295 177.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -80.58 -38.53 29.29 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.69 1.196 . . . . 0.0 113.151 -169.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -138.6 14.73 2.73 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.27 1.028 . . . . 0.0 113.084 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.668 1.987 . . . . 0.0 113.181 -174.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -90.05 119.61 30.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.069 0.948 . . . . 0.0 110.457 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -87.67 118.32 27.08 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.634 1.574 . . . . 0.0 111.631 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -117.67 136.64 53.19 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.442 1.897 . . . . 0.0 112.012 172.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.32 127.37 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.314 1.446 . . . . 0.0 111.084 174.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -66.41 89.6 0.14 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.092 1.357 . . . . 0.0 112.523 -176.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 128.041 2.536 . . . . 0.0 112.565 176.797 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.7 p-80 -76.98 160.94 28.75 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.486 1.115 . . . . 0.0 112.569 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 14.8 tpt -86.94 129.34 34.92 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.951 0.9 . . . . 0.0 111.259 174.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -153.47 134.65 14.09 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.99 1.316 . . . . 0.0 111.587 172.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.0 p -159.98 153.89 19.53 Favored Pre-proline 0 N--CA 1.474 0.752 0 C-N-CA 125.559 1.543 . . . . 0.0 111.618 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -77.14 168.83 22.55 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.106 2.537 . . . . 0.0 111.751 170.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -124.4 109.13 12.92 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.489 1.515 . . . . 0.0 109.679 169.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -78.78 147.91 33.13 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -171.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 1.3 m -79.3 -35.91 40.47 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -153.52 163.26 40.26 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.156 1.783 . . . . 0.0 110.738 -176.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.91 -25.22 68.05 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -172.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -63.63 -42.47 98.17 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 118.761 0.709 . . . . 0.0 111.302 173.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.38 -42.88 96.77 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.899 0.88 . . . . 0.0 110.952 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -51.23 64.48 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.634 0.774 . . . . 0.0 111.961 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.57 -41.11 93.94 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.408 0.683 . . . . 0.0 112.404 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 53.7 mt -58.8 -51.91 66.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 124.679 1.192 . . . . 0.0 111.048 175.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.7 -50.62 71.74 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.16 0.584 . . . . 0.0 110.888 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -61.92 -41.82 98.37 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.909 1.684 . . . . 0.0 112.238 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -59.89 -54.45 46.08 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.434 1.094 . . . . 0.0 111.496 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.95 -19.23 63.38 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.647 -1.283 . . . . 0.0 113.178 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -73.56 -36.26 65.59 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.988 0.915 . . . . 0.0 111.361 169.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -83.24 -39.53 20.77 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.261 0.624 . . . . 0.0 112.34 -173.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.32 -28.92 13.08 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -167.19 23.8 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -172.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -64.29 126.71 17.56 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 124.091 3.194 . . . . 0.0 114.262 -169.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -140.58 163.01 34.0 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.437 1.495 . . . . 0.0 111.274 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -79.56 161.87 25.7 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.058 -1.651 . . . . 0.0 112.561 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.48 -33.46 63.7 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.47 0.708 . . . . 0.0 112.249 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -64.99 -41.79 95.09 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.023 -0.423 . . . . 0.0 111.289 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 28.4 t -59.45 -45.27 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.16 0.584 . . . . 0.0 109.856 174.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.8 mm -62.47 -43.79 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 123.952 0.901 . . . . 0.0 110.43 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.33 -53.72 54.94 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.615 1.166 . . . . 0.0 110.015 -177.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -63.52 -34.0 76.81 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.2 0.6 . . . . 0.0 112.071 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.96 -25.58 64.62 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.6 mt -87.93 -11.91 46.2 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.781 1.632 . . . . 0.0 112.998 169.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.05 11.29 57.75 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.894 1.235 . . . . 0.0 114.26 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 31.5 mtt -81.47 176.88 9.32 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.441 1.896 . . . . 0.0 111.414 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -108.23 -31.91 7.7 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 68.4 p -134.85 155.02 51.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.551 1.14 . . . . 0.0 112.492 -169.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.02 -26.04 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.224 1.009 . . . . 0.0 113.667 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -68.4 -27.64 66.39 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.654 1.182 . . . . 0.0 113.679 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.28 -23.19 62.83 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.044 0.45 . . . . 0.0 111.431 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.05 -31.37 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.212 -0.93 . . . . 0.0 112.666 -177.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.62 -40.87 20.64 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.51 1.524 . . . . 0.0 112.539 -173.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -42.38 71.74 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 175.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -78.12 -42.08 33.04 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.83 0.852 . . . . 0.0 112.216 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.5 -52.39 65.41 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.84 0.856 . . . . 0.0 112.398 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -35.01 79.27 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.409 0.684 . . . . 0.0 110.973 179.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.2 mtp-105 -60.77 -45.44 94.32 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.411 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.58 -35.63 81.62 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.32 1.048 . . . . 0.0 111.548 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -64.31 -38.52 91.32 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.839 -1.163 . . . . 0.0 113.529 171.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.1 t -69.72 -17.9 63.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 174.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -113.83 15.3 18.67 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.84 38.52 0.93 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.561 1.544 . . . . 0.0 113.613 175.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.47 -32.04 3.92 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.946 1.698 . . . . 0.0 113.343 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -127.35 163.94 22.89 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 119.386 0.993 . . . . 0.0 113.275 175.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -148.34 115.33 6.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.167 2.187 . . . . 0.0 108.988 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.8 ttp -87.97 143.97 26.81 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.493 -0.754 . . . . 0.0 111.679 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.91 124.77 45.58 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 125.15 1.38 . . . . 0.0 110.265 175.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.69 -5.79 40.0 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.21 -0.931 . . . . 0.0 113.03 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -83.51 -33.65 25.49 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.729 1.212 . . . . 0.0 112.731 -176.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.3 t -143.96 10.75 1.56 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.879 1.272 . . . . 0.0 113.336 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.3 mmmt 52.81 36.75 22.2 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.388 2.275 . . . . 0.0 113.439 -169.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.94 119.35 27.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.614 0.766 . . . . 0.0 110.101 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.98 122.53 27.9 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 124.72 1.208 . . . . 0.0 110.857 172.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.14 130.61 51.37 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.145 1.778 . . . . 0.0 108.673 -178.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.37 127.81 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 120.747 -1.221 . . . . 0.0 110.506 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -67.99 89.17 0.29 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.922 1.289 . . . . 0.0 111.886 -177.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? . . . . . 0 C--O 1.251 1.174 0 C-N-CA 127.358 2.263 . . . . 0.0 111.297 -179.226 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.2 m . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.483 ' CG ' ' H ' ' A' ' 100' ' ' MET . 34.6 t60 60.42 170.7 0.09 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.941 2.096 . . . . 0.0 114.982 -175.04 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.483 ' H ' ' CG ' ' A' ' 99' ' ' HIS . 65.6 mtt -71.25 160.36 32.97 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.899 1.679 . . . . 0.0 112.58 178.007 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.03 6.08 23.44 Favored 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.0 m -129.81 151.06 77.53 Favored Pre-proline 0 N--CA 1.475 0.818 0 C-N-CA 126.407 1.883 . . . . 0.0 111.41 -177.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -76.14 172.23 16.65 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.364 2.709 . . . . 0.0 112.936 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -123.95 119.98 31.16 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.133 1.773 . . . . 0.0 108.945 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -82.01 145.52 30.19 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -169.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 44.6 m -70.53 -34.38 72.21 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.087 0.955 . . . . 0.0 113.139 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -157.05 170.55 22.27 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.763 1.625 . . . . 0.0 110.947 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.64 -24.62 66.84 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 -66.16 -47.14 75.0 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.191 0.905 . . . . 0.0 111.049 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -55.92 -47.92 76.64 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.833 0.742 . . . . 0.0 111.728 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -58.13 -50.56 73.06 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.434 0.693 . . . . 0.0 112.467 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -42.72 99.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.318 176.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 48.9 mt -56.41 -51.49 63.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 111.148 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.7 t80 -65.13 -50.44 66.0 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.593 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -55.51 -49.1 73.48 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.73 1.212 . . . . 0.0 112.157 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -56.18 -53.91 51.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.03 0.932 . . . . 0.0 111.455 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.4 mt -70.77 -19.63 62.69 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 120.802 -1.187 . . . . 0.0 112.944 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.59 -37.4 68.16 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.915 0.78 . . . . 0.0 110.895 169.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -81.22 -39.52 25.25 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.16 -28.22 13.13 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.13 -167.84 25.41 Favored Glycine 0 N--CA 1.471 0.97 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 -171.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -64.55 128.38 21.08 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.761 2.974 . . . . 0.0 114.103 -169.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.9 mm-40 -140.29 162.79 34.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.366 1.466 . . . . 0.0 110.662 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -81.32 161.4 23.87 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 120.159 -1.588 . . . . 0.0 112.008 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.02 -31.93 63.54 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.052 0.541 . . . . 0.0 112.326 -177.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.2 tp -65.16 -42.0 94.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.948 -0.47 . . . . 0.0 111.219 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.6 t -59.0 -44.99 92.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.055 0.542 . . . . 0.0 109.803 173.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 mm -63.88 -43.6 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.745 0.818 . . . . 0.0 110.78 -179.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.08 -54.22 45.93 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.131 1.372 . . . . 0.0 110.153 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -64.17 -34.21 77.56 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.972 0.509 . . . . 0.0 111.964 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.99 -25.92 64.76 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.8 mt -86.68 -11.96 49.75 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.684 1.594 . . . . 0.0 113.134 169.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.37 11.67 60.72 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.708 1.147 . . . . 0.0 113.901 -178.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.0 mmt -85.64 175.69 8.61 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.448 1.899 . . . . 0.0 111.004 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -107.94 -36.58 6.32 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -173.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.7 p -127.12 155.7 42.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.598 1.159 . . . . 0.0 112.403 -171.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.28 -24.64 66.54 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.508 1.123 . . . . 0.0 113.265 175.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -67.4 -28.16 67.68 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.02 1.328 . . . . 0.0 113.402 174.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -71.74 -15.42 62.19 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.268 0.627 . . . . 0.0 112.479 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -113.59 -31.09 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.427 1.091 . . . . 0.0 113.062 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.32 -41.99 40.19 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.878 1.271 . . . . 0.0 112.213 -175.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 -55.33 -37.72 67.79 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.44 1.096 . . . . 0.0 113.215 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -81.16 -45.51 16.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.289 1.036 . . . . 0.0 111.558 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.5 mt -58.57 -52.51 65.37 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.327 -178.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.57 -34.48 77.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.036 0.934 . . . . 0.0 111.033 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.7 mtp-105 -64.28 -45.02 89.83 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.279 174.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.96 -35.36 79.9 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.14 0.976 . . . . 0.0 110.801 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -63.4 -40.17 96.5 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.8 -1.188 . . . . 0.0 112.996 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 43.2 m -73.96 -13.82 60.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.568 1.147 . . . . 0.0 114.032 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -113.85 15.42 18.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.753 1.621 . . . . 0.0 115.04 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 72.43 39.05 0.76 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.584 1.554 . . . . 0.0 114.178 175.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -122.82 -31.87 3.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.184 1.794 . . . . 0.0 113.371 -177.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mt -128.87 166.24 19.47 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.575 1.08 . . . . 0.0 113.732 176.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -149.17 119.43 7.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.322 1.849 . . . . 0.0 109.556 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.7 ttp -86.75 144.27 27.15 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.208 -0.932 . . . . 0.0 111.922 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -86.94 130.98 34.23 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.943 1.297 . . . . 0.0 109.813 171.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.06 -10.4 59.73 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 124.637 1.175 . . . . 0.0 112.957 173.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -87.99 -38.53 15.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.409 0.684 . . . . 0.0 112.758 -171.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.6 t -143.74 18.9 1.83 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.176 0.99 . . . . 0.0 113.656 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.78 39.3 28.5 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.303 1.841 . . . . 0.0 113.512 -175.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.6 118.3 25.02 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.935 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -82.92 124.32 30.24 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 110.725 175.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.74 133.13 50.94 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.792 1.637 . . . . 0.0 108.869 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.33 131.61 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.564 1.146 . . . . 0.0 110.743 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -67.87 98.01 0.7 Allowed 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.946 0.879 . . . . 0.0 111.212 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 . . . . . 0 C--O 1.254 1.294 0 C-N-CA 127.215 2.206 . . . . 0.0 112.108 -176.819 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.2 m . . . . . 0 N--CA 1.488 1.458 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -128.73 151.62 49.34 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.359 1.463 . . . . 0.0 111.798 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -104.1 86.86 2.64 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.806 1.242 . . . . 0.0 110.783 -174.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.05 -3.58 49.17 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 36.5 m -161.92 154.26 16.54 Favored Pre-proline 0 N--CA 1.474 0.758 0 C-N-CA 127.815 2.446 . . . . 0.0 110.061 171.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -75.32 173.41 14.55 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.332 2.688 . . . . 0.0 112.525 175.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -123.9 111.78 16.47 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.972 1.709 . . . . 0.0 109.286 171.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -78.62 146.63 34.01 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -169.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.5 t -75.04 -35.5 61.9 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.114 0.965 . . . . 0.0 112.414 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -153.06 171.28 18.64 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.012 1.325 . . . . 0.0 112.351 176.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.47 -32.65 58.13 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.797 1.239 . . . . 0.0 113.234 178.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -66.68 -49.72 65.19 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.209 0.913 . . . . 0.0 111.567 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.06 -48.16 70.88 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.138 0.881 . . . . 0.0 111.915 174.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -55.26 -52.1 64.5 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.313 1.045 . . . . 0.0 112.588 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -38.44 85.24 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.377 179.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 44.3 mt -57.33 -50.42 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 119.287 0.949 . . . . 0.0 110.873 178.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -63.84 -51.36 65.02 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.329 0.652 . . . . 0.0 110.694 -178.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -57.95 -43.96 86.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.09 1.356 . . . . 0.0 112.921 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -59.66 -53.69 55.1 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.297 1.039 . . . . 0.0 111.422 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.68 -18.96 62.82 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.827 -1.171 . . . . 0.0 113.04 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -73.48 -36.36 65.8 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.696 0.799 . . . . 0.0 110.891 169.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.64 -38.55 23.37 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.28 0.632 . . . . 0.0 112.378 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.17 -27.7 13.08 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 95.81 -167.7 25.76 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -63.76 127.76 20.43 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 124.05 3.167 . . . . 0.0 114.228 -169.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -141.3 162.36 35.68 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.401 1.48 . . . . 0.0 111.281 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 -80.57 161.38 24.8 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 120.159 -1.588 . . . . 0.0 112.298 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . 0.401 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.82 -32.33 63.47 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.19 0.596 . . . . 0.0 112.428 -177.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.3 tp -66.38 -39.98 89.42 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.832 -0.543 . . . . 0.0 111.347 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 32.4 t -59.88 -45.7 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 122.927 0.491 . . . . 0.0 109.676 173.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.401 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -63.16 -43.38 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.93 0.892 . . . . 0.0 110.688 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.58 -55.11 35.85 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.203 1.401 . . . . 0.0 110.15 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -64.67 -33.95 77.14 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.939 0.496 . . . . 0.0 111.925 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.85 -26.79 65.33 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 177.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.5 mt -85.96 -12.01 51.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.036 169.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.92 10.6 59.78 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.803 1.192 . . . . 0.0 113.937 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.3 mmt -83.44 176.81 8.8 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.402 1.881 . . . . 0.0 111.109 175.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 88.3 mmt-85 -108.14 -31.06 8.07 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -174.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 66.5 p -135.58 156.56 48.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.337 1.055 . . . . 0.0 112.335 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.17 -25.18 66.84 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.646 1.178 . . . . 0.0 113.371 176.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.04 -27.48 66.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.267 1.427 . . . . 0.0 113.476 174.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.89 -15.33 62.11 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.384 0.673 . . . . 0.0 112.258 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -114.54 -31.56 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 124.398 1.079 . . . . 0.0 113.061 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -48.29 -40.72 25.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.056 1.343 . . . . 0.0 112.729 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -55.82 -44.38 77.86 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.727 1.211 . . . . 0.0 112.683 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.22 -43.02 58.79 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.653 1.181 . . . . 0.0 111.849 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.97 -52.43 65.03 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.124 0.97 . . . . 0.0 112.131 -176.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.11 79.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.304 0.641 . . . . 0.0 110.768 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 -64.3 -42.06 96.54 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 118.523 -0.751 . . . . 0.0 110.857 176.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.33 -34.91 79.22 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.187 0.995 . . . . 0.0 111.411 175.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -64.98 -38.26 90.39 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.791 -1.193 . . . . 0.0 113.232 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.58 -17.49 63.55 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -113.73 15.2 18.8 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.49 38.68 0.98 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.6 1.56 . . . . 0.0 113.824 175.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.8 mp -120.63 -32.67 3.99 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.008 1.723 . . . . 0.0 112.959 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mt -129.11 164.29 23.63 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 177.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -149.3 115.38 5.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.274 1.83 . . . . 0.0 109.603 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.3 ttp -84.0 145.15 28.67 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 111.802 174.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -91.11 130.36 37.01 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.049 1.339 . . . . 0.0 109.815 171.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.66 -9.22 58.44 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 124.084 0.954 . . . . 0.0 113.05 173.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -87.45 -36.67 17.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.564 0.746 . . . . 0.0 112.865 -172.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.1 t -143.62 18.01 1.84 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.222 1.009 . . . . 0.0 113.551 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 52.39 40.0 28.58 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 126.813 2.045 . . . . 0.0 113.826 -175.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.74 119.74 27.29 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.426 0.691 . . . . 0.0 109.79 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -82.96 125.15 31.07 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.773 1.229 . . . . 0.0 110.953 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.2 p -130.58 128.29 40.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.234 1.414 . . . . 0.0 108.594 -173.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.62 129.16 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 120.597 -1.315 . . . . 0.0 110.947 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.33 89.25 0.33 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.689 1.195 . . . . 0.0 112.216 -177.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 C--O 1.253 1.239 0 C-N-CA 127.204 2.202 . . . . 0.0 112.012 178.018 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.9 m . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -80.36 152.53 28.86 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.121 0.873 . . . . 0.0 112.181 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -78.48 131.74 36.98 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.328 0.651 . . . . 0.0 110.427 173.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -146.93 171.11 15.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.318 1.447 . . . . 0.0 111.887 -177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 29.0 p -61.57 143.93 93.07 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 123.905 0.882 . . . . 0.0 112.718 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -74.22 177.57 8.09 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 124.068 3.179 . . . . 0.0 113.338 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -118.38 115.74 25.29 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.833 1.653 . . . . 0.0 108.804 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -81.1 148.27 29.71 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -169.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 3.6 m -82.55 -31.2 29.2 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.07 0.948 . . . . 0.0 113.26 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -155.12 166.0 34.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.855 1.662 . . . . 0.0 111.254 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -25.39 65.26 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -176.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -72.48 -40.03 67.25 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 118.902 0.774 . . . . 0.0 111.536 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.52 -44.8 89.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.91 0.884 . . . . 0.0 110.058 173.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.16 -55.17 31.33 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.835 0.854 . . . . 0.0 113.081 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -40.53 93.11 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 118.769 0.713 . . . . 0.0 112.324 -177.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 55.5 mt -61.91 -51.87 67.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 119.426 1.012 . . . . 0.0 111.381 178.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -64.02 -48.41 76.47 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.419 0.288 . . . . 0.0 110.782 -177.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -55.57 -50.53 69.82 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.1 1.36 . . . . 0.0 112.382 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.87 -52.04 65.46 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.922 0.889 . . . . 0.0 111.568 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.28 -19.79 63.08 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.92 -1.112 . . . . 0.0 112.931 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -73.3 -37.02 66.36 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.904 0.774 . . . . 0.0 111.185 169.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -80.73 -38.39 28.83 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 -173.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.18 -27.99 12.91 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -168.87 24.85 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -172.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -62.06 128.35 23.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.033 3.155 . . . . 0.0 113.888 -171.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.5 mm-40 -141.34 163.94 31.58 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.222 1.409 . . . . 0.0 111.189 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 52.2 mtt85 -81.63 159.98 23.87 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 120.322 -1.486 . . . . 0.0 111.928 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.66 -32.45 63.23 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.221 0.608 . . . . 0.0 112.535 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.18 -42.05 94.01 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.792 0.437 . . . . 0.0 111.38 177.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.02 -44.73 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.226 0.61 . . . . 0.0 109.647 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.7 mm -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.432 0.693 . . . . 0.0 110.853 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.3 -53.97 49.48 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.052 1.341 . . . . 0.0 110.047 -178.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -63.95 -34.07 77.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.223 0.609 . . . . 0.0 112.022 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.82 -24.58 64.4 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.6 mt -89.99 -11.94 40.12 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.386 1.474 . . . . 0.0 113.168 169.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.04 10.46 61.16 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 125.007 1.289 . . . . 0.0 113.942 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.5 mmt -82.78 173.57 11.75 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.906 1.682 . . . . 0.0 110.684 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -108.03 -30.65 8.33 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -169.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 67.7 p -135.97 155.98 49.45 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.633 1.173 . . . . 0.0 112.012 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.85 -27.65 65.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.31 -25.56 64.29 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.898 1.279 . . . . 0.0 113.721 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.22 -27.48 66.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.272 0.558 . . . . 0.0 111.113 176.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.52 -31.18 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 123.62 0.768 . . . . 0.0 112.457 -172.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.37 -41.0 12.89 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 112.401 -175.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -54.2 -44.32 71.51 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.732 1.213 . . . . 0.0 113.261 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.27 -42.64 44.88 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.999 0.92 . . . . 0.0 111.568 175.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.17 -52.84 63.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.923 . . . . 0.0 112.255 -177.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -34.03 77.44 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.783 0.833 . . . . 0.0 111.081 176.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.1 mtp85 -58.98 -46.99 86.75 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.39 173.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 41.1 mtm -64.28 -34.65 78.6 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.427 0.691 . . . . 0.0 112.274 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -65.01 -34.34 78.21 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.1 t -75.29 -16.27 60.44 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 173.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -114.04 15.23 18.42 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 6.0 t60 71.54 40.0 0.85 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.494 1.518 . . . . 0.0 114.068 175.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.85 -33.13 3.41 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.249 1.82 . . . . 0.0 113.304 -177.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.7 mt -129.51 163.95 24.81 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.737 1.153 . . . . 0.0 113.575 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -149.06 117.02 6.31 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.208 1.803 . . . . 0.0 109.772 176.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.0 ttp -85.38 143.66 28.49 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.106 0.562 . . . . 0.0 112.088 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.23 123.59 42.39 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 125.909 1.684 . . . . 0.0 109.688 172.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.25 -5.5 36.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.736 0.814 . . . . 0.0 112.876 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -75.84 -36.25 59.7 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.189 1.395 . . . . 0.0 112.355 -178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -148.2 16.45 1.06 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mptt 52.69 40.9 31.13 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.501 1.92 . . . . 0.0 113.004 -170.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -81.88 118.79 23.2 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.663 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -84.22 124.78 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.929 1.291 . . . . 0.0 110.819 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.5 p -130.47 127.99 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.173 1.389 . . . . 0.0 108.385 -172.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.47 130.48 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 120.606 -1.309 . . . . 0.0 111.077 -179.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.84 96.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 122.221 1.01 . . . . 0.0 111.793 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.806 2.443 . . . . 0.0 110.937 -176.362 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.4 m . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -78.95 163.91 24.85 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.463 1.105 . . . . 0.0 113.065 177.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 16.5 tpt -89.05 135.16 33.7 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.351 1.06 . . . . 0.0 111.513 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -146.05 159.01 43.87 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.398 1.479 . . . . 0.0 111.825 177.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 49.7 m 49.37 60.24 15.77 Favored Pre-proline 0 N--CA 1.478 0.942 0 C-N-CA 125.658 1.583 . . . . 0.0 113.952 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -71.41 172.0 15.06 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 124.0 3.133 . . . . 0.0 112.807 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -124.05 109.47 13.54 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.382 1.473 . . . . 0.0 110.557 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -82.14 147.41 29.06 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.233 1.013 . . . . 0.0 112.251 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 64.9 p -77.81 -33.41 52.47 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -153.65 166.37 33.01 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.895 1.278 . . . . 0.0 111.736 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -46.09 -37.67 7.1 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.081 1.752 . . . . 0.0 113.073 175.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -69.21 -41.22 77.37 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.04 0.836 . . . . 0.0 113.238 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -60.84 -45.73 93.32 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.22 0.918 . . . . 0.0 111.108 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.39 -49.5 77.04 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -43.86 95.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.727 0.811 . . . . 0.0 112.381 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 34.5 mt -58.59 -50.84 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.65 1.18 . . . . 0.0 111.508 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -62.64 -51.49 67.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.945 0.498 . . . . 0.0 111.076 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -61.22 -39.78 91.53 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.436 1.094 . . . . 0.0 112.344 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.48 -54.24 47.91 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.472 1.109 . . . . 0.0 111.482 173.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.46 -18.87 63.76 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.737 -1.227 . . . . 0.0 112.989 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -73.79 -37.15 65.04 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.896 0.878 . . . . 0.0 111.454 169.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.67 -38.89 25.18 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.323 0.649 . . . . 0.0 112.278 -173.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.09 -29.16 11.92 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.76 -167.82 23.37 Favored Glycine 0 N--CA 1.469 0.857 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -172.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.23 128.14 19.82 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.772 2.981 . . . . 0.0 113.814 -170.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -139.06 162.66 34.39 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.585 1.554 . . . . 0.0 111.19 -178.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -79.27 158.16 27.61 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.196 -1.565 . . . . 0.0 111.05 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.85 -31.72 59.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.262 0.625 . . . . 0.0 112.439 -179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.6 tp -64.86 -41.32 95.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.165 0.586 . . . . 0.0 111.699 177.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.24 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.565 0.746 . . . . 0.0 109.121 174.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 mm -61.52 -43.63 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.529 0.732 . . . . 0.0 110.453 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.19 -55.58 31.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.234 1.414 . . . . 0.0 109.875 -178.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -63.85 -34.63 78.37 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.289 0.636 . . . . 0.0 111.986 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.24 64.28 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.2 mt -89.96 -11.96 40.16 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.488 1.515 . . . . 0.0 113.236 170.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 95.64 5.88 59.87 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.288 1.423 . . . . 0.0 114.248 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 20.4 mmm -80.93 173.77 12.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.557 1.543 . . . . 0.0 110.902 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -106.77 -29.91 9.25 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -170.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.9 p -137.77 156.37 48.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.412 1.085 . . . . 0.0 112.206 -171.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.94 -28.66 64.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.345 1.058 . . . . 0.0 113.833 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.74 -25.1 63.67 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.866 1.266 . . . . 0.0 113.705 176.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.23 -28.5 67.29 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.219 0.533 . . . . 0.0 110.915 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.01 -31.47 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.531 0.732 . . . . 0.0 112.334 -172.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.29 -41.64 6.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.029 1.732 . . . . 0.0 112.872 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -44.84 75.73 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.621 1.168 . . . . 0.0 112.769 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -77.19 -38.7 51.0 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.033 0.933 . . . . 0.0 112.625 175.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.19 -51.4 67.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.768 0.827 . . . . 0.0 112.215 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -33.12 75.29 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.969 -0.457 . . . . 0.0 111.005 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -64.47 -41.22 96.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.355 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.3 mtp -63.86 -37.23 86.64 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.258 0.936 . . . . 0.0 111.997 172.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 120.452 -1.405 . . . . 0.0 112.321 173.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.6 t -67.04 -14.32 62.78 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.231 1.412 . . . . 0.0 114.111 175.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 -113.25 13.23 19.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.547 1.139 . . . . 0.0 114.009 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.6 t60 69.01 39.37 1.79 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.122 1.369 . . . . 0.0 113.087 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -121.71 -34.2 3.45 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.196 1.398 . . . . 0.0 113.478 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.5 mp -119.63 160.35 22.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.799 1.24 . . . . 0.0 112.673 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -144.38 115.38 7.86 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.966 1.706 . . . . 0.0 109.87 174.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.4 ttp -85.83 144.12 27.89 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.298 0.57 . . . . 0.0 111.979 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.15 119.93 40.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.862 1.665 . . . . 0.0 107.999 173.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.97 -12.47 60.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.906 0.882 . . . . 0.0 113.286 -172.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -77.52 -35.0 53.84 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.428 1.491 . . . . 0.0 112.68 -170.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.8 t -135.09 11.79 3.58 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.701 1.2 . . . . 0.0 112.797 171.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm 53.44 38.94 29.17 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.128 1.771 . . . . 0.0 112.232 -169.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.82 116.05 19.76 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.344 0.658 . . . . 0.0 109.438 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -81.08 125.37 30.12 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.628 1.171 . . . . 0.0 110.533 171.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.04 163.6 17.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 107.621 176.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.94 130.03 36.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 120.817 -1.177 . . . . 0.0 109.467 172.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -68.03 89.62 0.3 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.927 1.291 . . . . 0.0 111.539 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.4 ptt180 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 127.075 2.15 . . . . 0.0 113.004 178.254 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.5 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 120.452 0.168 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -147.06 160.21 42.67 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.692 1.597 . . . . 0.0 112.283 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 93.4 mmm 52.33 41.94 30.76 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.689 1.596 . . . . 0.0 113.985 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.54 161.11 33.37 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.445 1.498 . . . . 0.0 113.154 -174.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 50.4 m -64.08 155.28 79.31 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 125.466 1.506 . . . . 0.0 112.948 177.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.9 171.72 14.1 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.195 2.596 . . . . 0.0 111.957 172.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -124.1 117.69 25.23 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.201 1.4 . . . . 0.0 110.538 174.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -88.44 144.28 26.47 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.064 0.946 . . . . 0.0 111.016 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.9 m -78.48 -27.58 46.31 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.982 0.913 . . . . 0.0 112.925 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -158.41 166.85 31.22 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.712 1.605 . . . . 0.0 110.945 177.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -25.52 68.08 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -173.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -56.06 -47.12 78.53 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 118.774 0.715 . . . . 0.0 111.475 172.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -61.32 -43.14 99.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 122.943 0.497 . . . . 0.0 110.809 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.44 -48.79 80.3 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 122.003 -0.436 . . . . 0.0 112.091 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.565 0.746 . . . . 0.0 112.271 178.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 25.1 mt -55.89 -51.27 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.985 1.314 . . . . 0.0 111.332 177.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -63.49 -51.45 65.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.716 0.406 . . . . 0.0 111.025 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -56.49 -41.63 76.93 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.983 1.313 . . . . 0.0 112.67 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -62.75 -53.26 57.02 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.844 1.258 . . . . 0.0 111.49 175.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.71 -18.71 63.56 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.884 -1.135 . . . . 0.0 112.681 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -73.7 -37.12 65.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 118.938 0.79 . . . . 0.0 111.474 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.96 -38.71 27.24 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.384 0.674 . . . . 0.0 112.319 -173.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -28.69 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.76 -169.23 25.52 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.95 130.24 26.97 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.497 2.798 . . . . 0.0 114.09 -170.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -139.07 163.56 32.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.604 1.562 . . . . 0.0 110.832 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -78.61 157.67 28.65 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 120.21 -1.556 . . . . 0.0 111.106 177.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -53.26 -33.92 55.09 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.759 0.824 . . . . 0.0 112.524 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.07 -41.26 95.27 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.331 0.652 . . . . 0.0 111.879 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.6 t -59.61 -46.05 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.8 mm -60.74 -43.18 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.347 0.659 . . . . 0.0 110.328 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.5 -54.21 49.44 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.024 -177.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.86 -33.51 76.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.313 0.645 . . . . 0.0 112.119 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.18 -25.13 64.19 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 123.673 0.789 . . . . 0.0 112.962 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.9 mt -89.95 -11.86 40.48 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.678 1.591 . . . . 0.0 113.334 170.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.48 11.48 59.45 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.689 1.138 . . . . 0.0 114.381 -178.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 33.3 mtt -80.32 176.86 9.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.218 1.807 . . . . 0.0 111.116 171.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 86.0 mtt85 -107.69 -36.8 6.32 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -175.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -132.41 157.01 45.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.459 1.104 . . . . 0.0 112.506 -170.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.45 -27.51 66.14 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.78 1.029 . . . . 0.0 113.78 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -70.58 -23.5 62.6 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.644 1.578 . . . . 0.0 113.986 175.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -71.39 -25.17 62.24 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.276 0.489 . . . . 0.0 111.078 174.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.16 -31.45 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.404 0.682 . . . . 0.0 112.634 -175.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.38 -38.58 13.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.553 1.541 . . . . 0.0 113.325 -173.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -47.6 76.86 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.668 1.587 . . . . 0.0 112.441 174.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -72.72 -41.1 65.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.863 1.265 . . . . 0.0 111.904 176.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.42 -52.14 62.81 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.676 0.79 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.63 -33.67 76.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.844 0.458 . . . . 0.0 110.676 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -67.58 -39.29 84.87 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.03 177.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.74 -37.26 85.89 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 119.704 1.138 . . . . 0.0 111.924 171.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -64.79 -41.17 96.04 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.645 -1.284 . . . . 0.0 112.194 173.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -66.62 -13.99 61.85 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.994 1.318 . . . . 0.0 114.182 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -113.17 13.0 19.18 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.821 1.248 . . . . 0.0 113.972 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.5 t60 69.49 39.32 1.61 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.225 1.41 . . . . 0.0 113.324 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -121.47 -34.27 3.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.333 1.453 . . . . 0.0 113.153 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.3 mp -119.9 160.76 22.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.931 1.293 . . . . 0.0 113.11 175.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -142.66 115.55 8.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.348 1.859 . . . . 0.0 110.185 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.2 ttp -88.27 143.66 26.9 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.087 -1.008 . . . . 0.0 112.25 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -89.39 130.81 35.7 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.849 1.26 . . . . 0.0 108.342 169.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.52 -14.11 61.16 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 121.09 -1.006 . . . . 0.0 112.536 175.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -85.35 -37.65 19.66 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -169.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -137.17 13.43 3.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.437 1.095 . . . . 0.0 113.148 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 52.52 42.14 31.25 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.221 1.809 . . . . 0.0 113.035 -176.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.13 117.61 25.98 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.903 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -83.98 120.0 25.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.633 1.173 . . . . 0.0 110.639 173.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.22 165.5 11.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.811 2.044 . . . . 0.0 108.786 170.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.24 127.65 39.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.471 1.108 . . . . 0.0 109.637 170.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -66.15 88.65 0.12 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.392 1.477 . . . . 0.0 112.027 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 45.8 ttm105 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 127.023 2.129 . . . . 0.0 112.037 178.877 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 37.3 m80 62.34 165.67 0.11 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 127.613 2.365 . . . . 0.0 115.287 -175.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 86.2 mmm 55.09 28.21 10.56 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.089 1.756 . . . . 0.0 114.832 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.54 148.07 27.41 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.489 1.116 . . . . 0.0 113.483 -173.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.8 m -86.62 156.54 55.99 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 125.24 1.416 . . . . 0.0 111.936 173.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -68.84 173.95 9.4 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.132 2.555 . . . . 0.0 112.154 169.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -123.7 115.55 21.61 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.891 1.676 . . . . 0.0 108.812 173.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -82.73 147.75 28.27 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -169.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 1.5 m -79.6 -31.75 41.8 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.905 0.882 . . . . 0.0 112.97 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -153.87 164.28 38.64 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.128 1.371 . . . . 0.0 112.452 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -47.94 -42.83 28.35 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.322 1.849 . . . . 0.0 112.945 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 -65.91 -42.05 90.67 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 121.62 -0.675 . . . . 0.0 111.478 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.96 -43.8 86.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.064 1.346 . . . . 0.0 111.045 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -64.92 -50.92 64.59 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.723 0.809 . . . . 0.0 112.385 176.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.45 -40.21 96.52 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.241 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 51.3 mt -57.91 -51.0 76.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 119.502 1.047 . . . . 0.0 110.992 176.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -63.54 -50.81 68.09 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.758 0.423 . . . . 0.0 110.663 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -58.96 -42.07 88.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.662 1.185 . . . . 0.0 112.963 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.47 -53.56 54.89 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.813 1.245 . . . . 0.0 111.685 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.91 -19.68 64.21 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.987 -1.071 . . . . 0.0 112.618 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -72.99 -37.21 67.08 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.899 0.88 . . . . 0.0 110.892 169.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -76.53 -41.26 47.36 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.947 0.499 . . . . 0.0 112.029 -174.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.12 -28.14 11.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -178.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.36 -168.48 25.53 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 -172.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -62.71 128.58 23.72 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.615 2.877 . . . . 0.0 114.155 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.0 mm-40 -138.96 164.21 30.32 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.132 1.373 . . . . 0.0 110.673 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 63.8 mtt85 -80.56 160.22 25.23 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.36 -1.462 . . . . 0.0 111.347 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.43 -33.07 63.24 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.278 0.631 . . . . 0.0 112.413 -177.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.3 tp -65.56 -39.79 92.07 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.255 0.622 . . . . 0.0 111.636 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.71 -46.3 96.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 174.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.7 mm -61.35 -43.06 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.26 0.624 . . . . 0.0 110.488 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.9 -54.31 48.4 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.662 1.185 . . . . 0.0 110.145 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.78 -33.63 76.44 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.209 0.604 . . . . 0.0 112.131 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.87 65.37 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.396 0.678 . . . . 0.0 112.789 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.1 mt -88.47 -11.89 44.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.746 1.619 . . . . 0.0 113.394 169.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 11.66 60.18 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 124.704 1.145 . . . . 0.0 114.206 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.0 mtt -79.6 176.95 9.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.23 1.812 . . . . 0.0 111.21 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.99 -35.43 6.62 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 70.2 p -133.13 155.73 48.75 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.699 1.2 . . . . 0.0 112.37 -170.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.3 -27.33 65.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.162 0.985 . . . . 0.0 113.655 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.35 -26.92 65.84 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -68.79 -25.97 64.97 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.044 0.45 . . . . 0.0 111.241 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.68 -31.11 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 121.241 -0.912 . . . . 0.0 112.509 -176.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.67 -41.59 22.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.848 1.659 . . . . 0.0 112.216 -174.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -54.67 -41.15 69.82 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.567 1.147 . . . . 0.0 113.12 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -78.68 -44.45 23.62 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.559 0.744 . . . . 0.0 111.708 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.28 -52.45 65.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.274 1.029 . . . . 0.0 112.581 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.81 81.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.758 0.823 . . . . 0.0 111.036 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -62.85 -42.01 99.58 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.796 175.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 87.5 mtp -65.77 -34.39 78.07 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.111 0.964 . . . . 0.0 111.091 176.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.9 tttp -65.12 -37.41 87.34 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.998 -1.064 . . . . 0.0 113.399 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -70.05 -18.04 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 174.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -113.75 15.85 18.64 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.44 38.6 1.0 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.487 1.515 . . . . 0.0 113.947 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.39 -32.4 3.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.966 1.707 . . . . 0.0 113.281 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.4 mt -129.08 164.51 23.13 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.491 1.041 . . . . 0.0 113.541 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -147.95 118.55 7.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.711 2.004 . . . . 0.0 109.398 175.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.6 ttp -88.35 143.15 27.19 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.132 -0.98 . . . . 0.0 112.083 173.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -87.22 129.69 34.87 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.95 1.3 . . . . 0.0 109.312 170.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -71.1 -13.0 61.81 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 124.029 0.932 . . . . 0.0 112.432 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 63.6 mm-40 -83.69 -42.6 16.45 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.121 0.968 . . . . 0.0 112.729 -171.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 21.5 t -136.82 15.48 3.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.545 1.138 . . . . 0.0 113.499 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? 52.26 40.99 30.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.553 1.541 . . . . 0.0 112.801 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.15 118.0 24.45 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.637 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -85.03 121.94 28.53 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.713 1.205 . . . . 0.0 111.149 177.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.2 133.34 54.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.994 1.718 . . . . 0.0 109.559 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.81 127.49 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 O-C-N 120.454 -1.404 . . . . 0.0 110.632 176.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.8 92.46 0.22 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.694 1.198 . . . . 0.0 111.937 -177.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.268 1.827 . . . . 0.0 113.826 178.275 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -131.86 158.65 40.78 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.446 1.499 . . . . 0.0 112.251 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.7 mmm -75.28 156.85 35.22 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.159 0.984 . . . . 0.0 111.979 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -136.52 148.66 47.73 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.516 1.126 . . . . 0.0 113.377 -176.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 58.8 p -157.73 158.37 30.35 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.354 2.262 . . . . 0.0 110.231 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -74.18 166.04 30.51 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.405 2.07 . . . . 0.0 111.57 176.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -124.36 112.48 17.0 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.815 1.646 . . . . 0.0 109.437 170.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -67.65 134.02 50.39 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.601 -0.687 . . . . 0.0 110.142 175.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 7.5 m -72.97 -29.35 63.01 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.295 1.038 . . . . 0.0 112.243 -174.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -158.67 168.99 25.39 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.718 2.007 . . . . 0.0 110.689 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -48.04 -35.4 11.06 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.808 1.643 . . . . 0.0 113.337 175.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 24.5 mtm180 -67.47 -39.59 85.3 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.88 -45.1 95.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.544 1.065 . . . . 0.0 111.062 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.36 -47.54 85.64 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.537 0.735 . . . . 0.0 111.469 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.5 -40.7 97.76 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.826 0.85 . . . . 0.0 113.254 177.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 30.2 mt -60.87 -50.24 81.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 124.359 1.063 . . . . 0.0 111.591 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -61.33 -51.35 69.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.662 0.267 . . . . 0.0 110.79 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -58.98 -42.08 89.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.19 1.396 . . . . 0.0 113.23 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -60.63 -53.68 54.54 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.28 1.032 . . . . 0.0 111.329 174.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.43 -19.6 62.97 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.768 -1.208 . . . . 0.0 112.877 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.95 -38.07 69.85 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.554 1.142 . . . . 0.0 111.043 169.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -82.16 -39.55 23.07 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.322 0.649 . . . . 0.0 112.295 -172.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.94 -28.94 12.1 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.75 -168.19 23.6 Favored Glycine 0 N--CA 1.47 0.946 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -171.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.33 129.12 20.75 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.562 2.841 . . . . 0.0 114.063 -169.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -140.61 161.03 38.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.774 1.629 . . . . 0.0 110.967 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -78.15 161.18 27.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 119.786 -1.822 . . . . 0.0 112.428 176.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . 0.405 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.83 -31.67 62.91 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.259 0.624 . . . . 0.0 112.423 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -41.15 92.48 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.876 -0.515 . . . . 0.0 111.478 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.7 t -59.46 -46.59 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.003 0.521 . . . . 0.0 109.679 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -61.82 -43.43 97.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.087 0.955 . . . . 0.0 110.232 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.91 -54.63 44.35 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.904 1.282 . . . . 0.0 110.061 -177.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -64.45 -34.78 79.0 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.161 0.585 . . . . 0.0 112.02 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.29 -25.47 64.26 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 5.2 mt -89.98 -12.12 39.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.554 1.542 . . . . 0.0 113.36 171.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 9.95 62.08 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.757 1.17 . . . . 0.0 114.475 -177.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 18.0 mmt -80.63 176.64 9.62 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.34 1.456 . . . . 0.0 110.632 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -108.09 -31.64 7.86 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -172.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 58.1 p -136.83 156.96 47.81 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.417 1.087 . . . . 0.0 112.234 -171.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -29.89 65.26 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.337 1.055 . . . . 0.0 113.758 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -69.19 -25.12 64.17 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.849 1.26 . . . . 0.0 113.639 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.7 -27.55 66.05 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.193 0.451 . . . . 0.0 110.966 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.8 -31.14 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.503 0.721 . . . . 0.0 112.565 -173.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.65 -41.64 6.84 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.098 1.759 . . . . 0.0 112.591 -176.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -54.73 -44.94 74.0 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.74 1.216 . . . . 0.0 113.106 175.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.7 -41.72 52.87 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.96 0.904 . . . . 0.0 111.846 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.0 mt -60.84 -52.48 64.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.454 1.101 . . . . 0.0 112.493 -177.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -33.1 75.2 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.351 0.661 . . . . 0.0 110.981 178.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -64.45 -42.15 96.14 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.99 176.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.0 mtp -64.47 -35.94 82.58 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.182 0.901 . . . . 0.0 112.136 173.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.18 -41.79 94.28 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.465 -1.397 . . . . 0.0 112.605 173.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.4 t -63.75 -16.15 60.43 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.45 1.1 . . . . 0.0 113.632 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -113.55 15.28 19.01 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 70.83 37.14 1.38 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.393 1.477 . . . . 0.0 113.389 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -121.62 -33.48 3.6 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.124 1.37 . . . . 0.0 113.62 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.8 mp -118.73 161.76 19.58 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.623 1.169 . . . . 0.0 112.53 172.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -144.58 120.49 10.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.441 1.496 . . . . 0.0 110.374 172.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.9 ttp -87.84 144.44 26.59 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.193 -0.942 . . . . 0.0 112.111 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.71 126.17 41.69 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 125.414 1.486 . . . . 0.0 109.977 173.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -74.0 -4.11 33.33 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 124.702 1.201 . . . . 0.0 113.629 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.7 -33.91 15.6 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.552 1.141 . . . . 0.0 112.817 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.5 t -141.26 10.19 2.1 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.855 1.262 . . . . 0.0 113.225 -178.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 51.04 38.12 19.74 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 127.189 2.196 . . . . 0.0 113.584 -169.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.01 117.79 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.995 -176.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.56 121.53 26.43 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.391 1.076 . . . . 0.0 110.459 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.2 164.41 13.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.89 2.076 . . . . 0.0 108.754 171.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.61 126.92 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 124.154 0.982 . . . . 0.0 108.516 169.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -64.0 88.81 0.05 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.576 1.551 . . . . 0.0 112.02 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.269 0 C-N-CA 127.987 2.515 . . . . 0.0 113.203 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.7 m . . . . . 0 N--CA 1.488 1.432 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -76.7 166.62 23.12 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.447 1.099 . . . . 0.0 112.587 176.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -63.16 152.76 36.47 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.9 0.88 . . . . 0.0 113.348 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -88.53 3.42 50.34 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 52.2 m -107.74 148.13 36.74 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.702 1.601 . . . . 0.0 112.309 -177.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -75.68 169.56 22.03 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 123.532 2.821 . . . . 0.0 111.864 172.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -124.44 109.29 13.1 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.354 1.462 . . . . 0.0 111.634 175.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -94.9 147.6 23.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.21 1.004 . . . . 0.0 112.785 174.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 3.4 m -92.58 -32.8 14.67 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.001 1.72 . . . . 0.0 112.935 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -154.69 170.99 20.25 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.931 1.692 . . . . 0.0 111.329 -176.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.04 -31.58 51.87 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.683 1.193 . . . . 0.0 113.3 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -68.47 -50.68 50.6 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.745 1.157 . . . . 0.0 112.074 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -55.11 -46.67 75.59 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.099 0.863 . . . . 0.0 112.122 175.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -55.46 -51.92 65.35 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.344 1.058 . . . . 0.0 113.264 173.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -37.38 83.23 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.232 -0.917 . . . . 0.0 112.504 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 33.9 mt -56.86 -49.5 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.858 0.863 . . . . 0.0 110.59 178.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -62.83 -52.35 63.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.279 0.632 . . . . 0.0 110.658 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -57.74 -42.87 84.81 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.302 1.441 . . . . 0.0 113.184 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -60.11 -54.44 45.84 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.535 1.134 . . . . 0.0 111.375 173.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.7 mt -71.0 -19.18 62.55 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.668 -1.27 . . . . 0.0 113.079 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -72.55 -37.55 68.24 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.36 1.064 . . . . 0.0 110.803 169.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.21 -39.79 22.62 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.221 0.609 . . . . 0.0 112.312 -172.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.62 -29.15 12.84 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 177.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.25 -169.17 24.83 Favored Glycine 0 N--CA 1.47 0.91 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -171.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -64.24 128.97 22.84 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.007 3.138 . . . . 0.0 114.122 -170.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -140.63 163.41 32.95 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.535 1.534 . . . . 0.0 110.762 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -80.43 161.98 24.66 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.137 -1.602 . . . . 0.0 112.401 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.9 -32.11 63.46 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.481 0.712 . . . . 0.0 112.545 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.77 -41.72 91.71 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.96 -0.463 . . . . 0.0 111.412 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.47 -45.39 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 122.906 0.482 . . . . 0.0 109.882 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.8 mm -62.44 -43.53 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.869 0.868 . . . . 0.0 110.468 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.52 -54.68 42.95 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.708 1.203 . . . . 0.0 109.989 -177.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.62 0.768 . . . . 0.0 111.971 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.86 -25.75 64.8 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.2 mt -89.45 -11.94 41.59 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.179 1.391 . . . . 0.0 113.192 170.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.9 6.73 63.28 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.226 1.393 . . . . 0.0 114.129 -177.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.7 mmt -77.76 172.54 13.27 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.281 1.432 . . . . 0.0 110.292 171.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -108.21 -30.33 8.43 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -135.1 156.75 48.49 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.742 1.217 . . . . 0.0 112.062 -174.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.43 -28.73 67.21 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -66.16 -29.38 69.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.894 1.278 . . . . 0.0 113.702 175.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.53 -26.78 67.31 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.641 0.257 . . . . 0.0 111.14 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.32 -31.11 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.598 0.759 . . . . 0.0 112.427 -175.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.18 -40.75 7.49 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.522 1.529 . . . . 0.0 113.066 -176.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -44.69 77.67 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.736 1.214 . . . . 0.0 113.021 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.49 -41.95 59.84 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.286 1.034 . . . . 0.0 111.828 175.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.44 -52.05 66.16 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.695 0.798 . . . . 0.0 112.463 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.75 -32.89 74.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.476 0.71 . . . . 0.0 111.241 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -70.28 -33.49 71.65 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.242 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 94.2 mtp -72.09 -34.29 68.54 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.598 1.159 . . . . 0.0 111.873 170.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -63.05 -42.09 99.63 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 120.424 -1.423 . . . . 0.0 112.411 172.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.5 m -67.17 -14.67 63.13 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -114.13 13.77 18.11 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.84 1.793 . . . . 0.0 115.84 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.48 38.02 0.85 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.44 1.496 . . . . 0.0 113.269 178.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.2 mp -119.8 -32.09 4.34 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.086 1.354 . . . . 0.0 113.275 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.9 mt -126.94 164.44 21.47 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.128 0.971 . . . . 0.0 113.13 175.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -149.37 121.93 8.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.653 1.981 . . . . 0.0 109.197 174.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.5 ttp -90.22 144.73 25.59 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.191 -0.943 . . . . 0.0 112.063 173.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.12 126.01 42.0 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.126 1.37 . . . . 0.0 110.26 174.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.25 -6.52 43.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.114 0.966 . . . . 0.0 113.181 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -87.29 -34.78 18.78 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.441 1.096 . . . . 0.0 113.117 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.4 t -141.31 10.4 2.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.827 1.251 . . . . 0.0 113.176 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 51.37 38.87 22.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 127.061 2.145 . . . . 0.0 113.521 -169.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.83 119.1 26.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.374 0.67 . . . . 0.0 109.962 -175.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -83.51 119.96 25.34 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.518 1.127 . . . . 0.0 110.652 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.97 135.13 54.34 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.969 1.707 . . . . 0.0 108.915 175.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -55.38 130.04 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 120.57 -1.331 . . . . 0.0 109.622 169.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -67.37 86.8 0.18 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.959 1.303 . . . . 0.0 112.36 -177.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 60.8 ttp85 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.178 2.991 . . . . 0.0 113.552 -178.344 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -89.7 -63.7 1.25 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.012 0.925 . . . . 0.0 112.541 -176.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 21.1 mmt 50.77 34.81 10.72 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 126.366 1.867 . . . . 0.0 115.549 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.87 153.28 43.5 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.769 0.827 . . . . 0.0 112.906 178.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 44.7 m -67.13 145.61 98.8 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 124.195 0.998 . . . . 0.0 112.519 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -80.46 171.39 14.82 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.542 2.828 . . . . 0.0 112.83 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -124.41 119.69 29.94 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.88 1.672 . . . . 0.0 110.096 169.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -90.8 154.59 19.41 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.1 t -96.15 -31.64 12.88 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.508 1.523 . . . . 0.0 113.214 177.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -144.62 162.43 36.67 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -48.61 -43.35 36.17 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.258 1.823 . . . . 0.0 112.97 178.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 -64.16 -40.5 96.27 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.472 0.578 . . . . 0.0 112.196 -178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.85 -44.81 96.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.068 0.947 . . . . 0.0 111.279 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.53 -46.58 82.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.654 0.781 . . . . 0.0 111.864 174.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.37 -44.95 92.66 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.649 0.78 . . . . 0.0 112.317 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 49.1 mt -58.65 -50.32 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.537 1.135 . . . . 0.0 111.12 178.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -64.77 -50.28 67.44 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.296 0.639 . . . . 0.0 110.821 -178.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -57.33 -45.95 83.77 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.727 1.211 . . . . 0.0 112.245 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -58.12 -53.99 52.02 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.093 0.957 . . . . 0.0 111.433 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.7 mt -70.48 -18.9 62.97 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.82 -1.175 . . . . 0.0 113.193 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -74.35 -36.12 63.59 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.557 0.743 . . . . 0.0 111.415 169.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -82.26 -38.67 24.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.528 0.731 . . . . 0.0 112.234 -173.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -28.62 12.7 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.42 -168.58 24.22 Favored Glycine 0 N--CA 1.469 0.898 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -172.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -62.49 127.88 22.05 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 124.066 3.177 . . . . 0.0 113.983 -171.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -141.28 163.12 33.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.205 1.402 . . . . 0.0 111.144 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 51.6 mtt85 -81.08 160.09 24.56 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.253 -1.529 . . . . 0.0 111.924 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.03 -31.82 63.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.138 0.575 . . . . 0.0 112.412 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.9 tp -64.83 -41.93 95.35 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.946 -0.471 . . . . 0.0 111.401 176.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.68 -45.34 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.096 0.558 . . . . 0.0 109.679 174.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.7 mm -62.64 -44.19 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 110.408 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.56 -54.76 40.01 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.105 1.362 . . . . 0.0 110.096 -177.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -64.0 -34.34 77.77 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.381 0.672 . . . . 0.0 112.102 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.17 -25.18 64.23 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.8 mt -88.94 -12.0 42.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.378 1.471 . . . . 0.0 113.157 169.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.86 11.0 59.47 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.838 1.209 . . . . 0.0 114.119 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.1 mmt -83.43 176.3 9.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.964 1.706 . . . . 0.0 110.817 172.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -105.88 -38.81 6.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -171.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.7 p -130.45 156.37 44.87 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.459 1.103 . . . . 0.0 112.504 -169.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -28.2 63.82 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.42 1.088 . . . . 0.0 113.802 175.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -69.3 -25.37 64.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.889 1.276 . . . . 0.0 113.797 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.29 -27.95 66.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.12 0.486 . . . . 0.0 111.095 176.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -101.67 -31.25 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.539 0.736 . . . . 0.0 112.531 -173.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.2 -41.45 8.29 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.048 1.739 . . . . 0.0 112.485 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -54.39 -43.55 71.51 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.581 1.152 . . . . 0.0 113.34 175.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.34 -45.32 32.67 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.548 0.739 . . . . 0.0 111.384 175.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.37 -52.04 66.98 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.326 1.05 . . . . 0.0 112.662 -177.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -36.15 82.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.629 0.772 . . . . 0.0 110.779 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -68.09 -37.38 81.14 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.771 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.7 mtp -67.41 -34.65 77.69 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.944 0.898 . . . . 0.0 111.19 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -61.9 -46.04 91.11 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 113.136 171.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 59.9 m -63.74 -16.04 60.11 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 4.5 ptp85 -113.82 16.24 18.48 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 176.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.3 t60 71.42 37.92 1.09 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.863 1.265 . . . . 0.0 113.241 175.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -118.84 -33.4 4.23 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.767 1.627 . . . . 0.0 112.674 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mt -128.31 164.33 22.85 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -150.87 116.51 5.46 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.115 1.766 . . . . 0.0 109.771 176.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 47.2 ttp -85.79 144.57 27.67 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.713 -0.617 . . . . 0.0 111.943 174.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.05 125.83 38.91 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.514 1.526 . . . . 0.0 108.977 170.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.0 -8.15 54.41 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.005 -1.059 . . . . 0.0 112.885 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -84.44 -35.66 22.88 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.866 1.266 . . . . 0.0 112.835 -171.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -139.46 14.25 2.56 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.032 0.933 . . . . 0.0 112.955 172.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt 54.01 41.18 32.13 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 127.156 2.182 . . . . 0.0 113.134 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.17 119.79 25.95 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.558 0.743 . . . . 0.0 109.863 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -83.59 124.61 30.96 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.964 1.306 . . . . 0.0 110.69 173.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.4 p -129.34 127.34 40.88 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.379 1.471 . . . . 0.0 107.8 -174.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.0 130.3 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.58 -1.325 . . . . 0.0 110.451 178.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -67.74 86.83 0.22 Allowed 'General case' 0 CA--C 1.547 0.828 0 CA-C-O 122.657 1.218 . . . . 0.0 112.032 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 . . . . . 0 C--O 1.253 1.285 0 C-N-CA 128.139 2.576 . . . . 0.0 111.85 -175.176 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.0 m . . . . . 0 N--CA 1.488 1.463 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -79.51 155.39 28.26 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.982 0.913 . . . . 0.0 111.948 175.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.5 mmt -104.52 9.66 35.39 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.08 1.352 . . . . 0.0 114.411 -171.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.08 143.99 33.5 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.532 1.133 . . . . 0.0 112.922 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.2 p -155.12 153.58 27.34 Favored Pre-proline 0 N--CA 1.475 0.794 0 C-N-CA 126.098 1.759 . . . . 0.0 110.678 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -78.46 167.94 22.12 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.745 2.297 . . . . 0.0 112.229 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -124.49 109.39 13.2 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.661 1.584 . . . . 0.0 109.746 169.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -75.4 132.84 41.15 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.63 -0.668 . . . . 0.0 110.499 175.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 9.2 t -77.3 -28.16 53.2 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.636 -0.665 . . . . 0.0 112.427 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -147.02 163.55 35.87 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.171 1.388 . . . . 0.0 112.204 177.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -49.01 -34.71 13.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.916 1.686 . . . . 0.0 113.233 177.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -67.36 -40.65 85.78 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -58.62 -49.07 78.85 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.115 0.87 . . . . 0.0 111.01 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.56 -46.43 86.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.005 0.522 . . . . 0.0 112.058 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.4 -42.62 98.79 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 41.8 mt -58.27 -49.73 80.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 C-N-CA 124.612 1.165 . . . . 0.0 110.814 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -61.76 -51.66 67.42 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.013 0.925 . . . . 0.0 111.263 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.3 ttp85 -61.27 -42.47 98.7 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.53 1.532 . . . . 0.0 112.377 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.6 -52.11 66.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.701 0.8 . . . . 0.0 111.452 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.4 mt -71.3 -18.43 62.41 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.934 -1.104 . . . . 0.0 112.859 178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.0 ttmt -69.96 -36.23 75.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.939 0.896 . . . . 0.0 110.386 169.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.28 -39.91 27.9 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -174.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -111.22 -21.04 12.1 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 86.85 -165.5 36.51 Favored Glycine 0 N--CA 1.476 1.34 0 CA-C-O 117.987 -1.451 . . . . 0.0 111.281 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -54.48 120.82 8.67 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.871 3.047 . . . . 0.0 114.531 -171.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -135.41 157.04 47.89 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.473 1.509 . . . . 0.0 110.175 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -76.63 162.21 27.92 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 119.932 -1.73 . . . . 0.0 111.867 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . 0.407 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.84 -30.97 62.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.169 0.588 . . . . 0.0 112.139 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.15 -42.5 93.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.792 -0.568 . . . . 0.0 111.288 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 36.3 t -59.3 -45.7 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.059 0.544 . . . . 0.0 109.669 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.407 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -62.61 -44.14 99.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.859 0.864 . . . . 0.0 110.294 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -54.99 -54.58 41.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.291 1.436 . . . . 0.0 109.954 -178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -64.53 -34.33 77.99 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.126 0.571 . . . . 0.0 112.036 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.83 -24.67 64.4 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.638 0.775 . . . . 0.0 113.041 177.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.6 mt -90.04 -11.93 40.03 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.66 1.584 . . . . 0.0 113.533 169.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.82 10.82 61.08 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.736 1.16 . . . . 0.0 114.345 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.41 175.78 9.58 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.928 1.691 . . . . 0.0 110.76 172.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -107.74 -34.92 6.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -170.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.2 p -131.95 155.99 46.96 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.541 1.136 . . . . 0.0 112.308 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.04 -28.33 64.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.517 1.127 . . . . 0.0 113.688 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.33 -25.49 64.23 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.878 1.271 . . . . 0.0 113.734 176.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -68.27 -27.43 66.32 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.283 0.492 . . . . 0.0 110.941 177.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.42 -31.22 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 123.592 0.757 . . . . 0.0 112.655 -173.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.28 -41.64 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.636 1.575 . . . . 0.0 112.741 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -41.14 69.96 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.803 1.241 . . . . 0.0 113.423 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -79.77 -41.49 26.45 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.2 1.0 . . . . 0.0 112.147 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.07 -52.79 63.42 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.591 0.756 . . . . 0.0 112.226 -178.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -34.19 77.67 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.744 0.818 . . . . 0.0 111.204 178.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 16.1 mtp-105 -60.19 -46.41 89.81 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.636 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 33.9 mtp -66.95 -35.13 79.29 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.057 0.943 . . . . 0.0 111.793 178.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -65.33 -38.31 89.74 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.667 -1.27 . . . . 0.0 113.121 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.5 m -72.1 -14.55 61.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.213 1.005 . . . . 0.0 113.574 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -113.92 13.48 18.33 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 178.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 73.26 36.71 0.8 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.882 1.673 . . . . 0.0 114.148 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.7 mp -121.38 -32.08 3.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.069 1.348 . . . . 0.0 113.668 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.7 mt -124.34 164.01 20.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.453 1.101 . . . . 0.0 113.036 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -148.42 115.42 6.1 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.348 1.859 . . . . 0.0 108.82 179.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.5 ttp -87.67 141.41 28.63 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.379 -0.826 . . . . 0.0 111.587 172.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.84 126.68 37.02 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 124.713 1.205 . . . . 0.0 110.066 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -71.48 -7.12 45.42 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 124.273 1.029 . . . . 0.0 113.19 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -90.22 -33.88 16.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.595 1.158 . . . . 0.0 112.882 -173.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.2 t -142.0 11.26 1.99 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.99 1.316 . . . . 0.0 113.127 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 51.29 37.77 19.64 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 127.361 2.264 . . . . 0.0 114.106 -171.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -89.59 116.88 28.06 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.602 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -79.2 122.34 26.16 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.044 1.337 . . . . 0.0 111.294 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.4 t -132.18 144.43 50.66 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.809 1.643 . . . . 0.0 112.914 171.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -55.73 125.79 11.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 126.088 1.755 . . . . 0.0 111.29 179.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -65.1 89.42 0.08 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.503 1.521 . . . . 0.0 112.829 -177.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 77.0 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 128.301 2.64 . . . . 0.0 112.279 171.346 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -73.24 -32.53 64.78 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.843 0.857 . . . . 0.0 113.208 -178.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.8 ptp -145.67 161.45 39.85 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.395 1.478 . . . . 0.0 112.192 175.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.97 162.77 24.73 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.289 1.036 . . . . 0.0 112.755 174.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 22.2 m 65.29 153.7 0.12 Allowed Pre-proline 0 N--CA 1.483 1.201 0 C-N-CA 127.227 2.211 . . . . 0.0 115.294 -178.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -73.64 171.64 17.39 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.313 2.675 . . . . 0.0 112.243 174.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -124.24 116.84 23.33 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.497 1.519 . . . . 0.0 111.264 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -98.37 144.15 28.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.487 1.115 . . . . 0.0 112.551 174.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 1.5 m -94.19 -29.89 14.89 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.887 1.675 . . . . 0.0 112.723 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -153.52 167.37 29.71 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.907 1.683 . . . . 0.0 111.421 -175.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -33.29 53.96 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.819 1.247 . . . . 0.0 113.237 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -68.8 -45.48 71.16 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.517 1.053 . . . . 0.0 112.307 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.9 -42.99 90.88 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 110.882 177.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.11 -50.92 68.61 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.415 1.086 . . . . 0.0 112.552 175.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -38.34 90.24 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.619 -0.705 . . . . 0.0 112.525 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 44.1 mt -58.69 -50.75 78.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 119.248 0.931 . . . . 0.0 110.746 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.36 -51.65 66.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.987 0.115 . . . . 0.0 110.749 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -57.38 -43.92 84.01 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.184 1.394 . . . . 0.0 113.07 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -59.16 -54.08 51.06 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.194 0.998 . . . . 0.0 111.286 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -70.93 -19.43 62.58 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.744 -1.222 . . . . 0.0 113.087 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -73.14 -36.89 66.75 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.075 0.95 . . . . 0.0 111.117 169.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -82.42 -39.14 23.03 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.339 0.656 . . . . 0.0 112.27 -172.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.14 -28.1 12.87 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 177.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.71 -168.62 25.14 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -62.41 128.49 23.83 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.993 3.129 . . . . 0.0 114.006 -170.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -139.74 164.25 30.45 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.14 1.376 . . . . 0.0 111.09 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.4 mtt-85 -78.86 157.53 28.31 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 120.432 -1.418 . . . . 0.0 111.119 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -53.81 -32.76 53.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.597 0.759 . . . . 0.0 112.542 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.1 tp -64.9 -41.05 95.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.245 0.618 . . . . 0.0 111.684 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 31.6 t -60.66 -45.43 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.8 mm -61.1 -44.07 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.428 0.691 . . . . 0.0 110.459 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.21 -54.98 38.79 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.131 1.372 . . . . 0.0 110.161 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -64.27 -34.3 77.8 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.275 0.63 . . . . 0.0 111.959 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.71 -24.82 64.53 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.0 mt -90.51 -12.02 38.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.087 1.355 . . . . 0.0 113.301 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.55 11.65 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.129 1.347 . . . . 0.0 114.371 -178.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.3 mmt -84.0 176.13 9.06 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.036 1.734 . . . . 0.0 110.99 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -107.49 -35.64 6.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -171.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.9 p -133.34 157.22 46.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.608 1.163 . . . . 0.0 112.05 -171.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.15 -28.22 66.38 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 176.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.75 -28.95 68.82 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.741 1.216 . . . . 0.0 113.765 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.92 -28.36 68.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.949 0.404 . . . . 0.0 111.116 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.34 -31.19 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.706 0.802 . . . . 0.0 112.239 -174.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.07 -41.22 7.46 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.733 1.613 . . . . 0.0 112.617 -175.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -55.48 -42.86 74.96 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.63 1.172 . . . . 0.0 113.465 176.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -77.24 -43.46 33.42 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.072 0.949 . . . . 0.0 111.562 174.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.6 mt -59.08 -51.92 67.98 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.073 0.949 . . . . 0.0 112.433 -177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -34.71 78.29 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.327 0.651 . . . . 0.0 111.256 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.1 mtt-85 -64.24 -38.77 92.24 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.075 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 91.1 mtp -67.65 -35.49 78.98 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.155 0.982 . . . . 0.0 111.997 174.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -63.3 -38.62 91.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.787 -1.196 . . . . 0.0 113.132 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.3 t -68.96 -18.17 64.04 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -113.84 15.89 18.53 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.812 1.782 . . . . 0.0 115.812 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 72.02 38.43 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.328 1.451 . . . . 0.0 113.395 175.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -120.66 -32.83 3.94 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.978 1.711 . . . . 0.0 113.081 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -128.02 163.7 23.98 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.5 1.045 . . . . 0.0 113.781 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -147.69 115.45 6.4 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.959 2.103 . . . . 0.0 108.969 178.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.9 ttp -88.47 143.87 26.71 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.687 -0.633 . . . . 0.0 111.757 174.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -89.68 130.6 35.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.74 1.216 . . . . 0.0 109.619 170.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.97 -7.57 54.92 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.975 0.91 . . . . 0.0 113.016 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -88.72 -34.16 17.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.33 0.652 . . . . 0.0 112.548 -173.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.21 13.13 1.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.47 1.108 . . . . 0.0 113.78 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt 53.07 38.98 28.77 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 126.227 1.811 . . . . 0.0 113.265 -174.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.65 118.37 23.8 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.589 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -85.2 122.67 29.72 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.456 1.103 . . . . 0.0 110.866 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -127.24 129.44 47.78 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.752 1.621 . . . . 0.0 108.555 -176.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.74 128.86 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 110.813 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -68.27 90.56 0.35 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.792 1.237 . . . . 0.0 112.031 -177.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? . . . . . 0 C--O 1.253 1.286 0 C-N-CA 127.539 2.336 . . . . 0.0 111.346 176.986 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 61.4 p . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 120.761 0.315 . . . . 0.0 111.745 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -141.95 152.3 43.37 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.2 1.4 . . . . 0.0 111.922 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 48.5 ttp -145.04 153.95 42.0 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.645 1.578 . . . . 0.0 110.627 176.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.09 4.56 6.57 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -172.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.6 p -70.0 141.65 89.61 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 124.718 1.207 . . . . 0.0 111.849 171.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -78.94 169.43 19.41 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.02 2.48 . . . . 0.0 112.932 -177.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -124.01 110.1 14.36 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.824 2.049 . . . . 0.0 108.526 170.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -76.98 143.84 39.16 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -169.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.0 t -78.29 -32.49 49.45 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.351 1.06 . . . . 0.0 112.733 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -151.54 164.63 36.41 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.633 1.173 . . . . 0.0 112.845 177.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -49.15 -39.06 27.5 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.89 1.676 . . . . 0.0 113.178 177.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 -68.12 -39.76 82.69 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.816 0.735 . . . . 0.0 112.289 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.79 -44.8 93.77 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.164 0.986 . . . . 0.0 110.585 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.88 -49.55 74.41 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.266 1.026 . . . . 0.0 112.45 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.63 -41.35 98.96 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.693 0.797 . . . . 0.0 113.028 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 45.6 mt -60.56 -49.55 83.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 124.231 1.012 . . . . 0.0 110.653 177.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.88 -50.67 69.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.668 0.387 . . . . 0.0 111.098 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -58.17 -44.46 88.0 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.351 1.46 . . . . 0.0 112.807 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -59.06 -53.34 59.46 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.951 0.9 . . . . 0.0 111.385 174.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.9 -18.69 62.66 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.773 -1.204 . . . . 0.0 113.104 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.4 ttmt -73.26 -36.0 66.29 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.69 0.796 . . . . 0.0 110.76 169.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.76 -38.34 21.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.403 0.681 . . . . 0.0 112.318 -171.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.93 -26.62 13.36 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 176.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.87 -167.25 26.68 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -172.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -63.86 128.2 21.43 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.943 3.095 . . . . 0.0 113.936 -170.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.6 mm-40 -139.52 164.65 29.34 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.27 1.428 . . . . 0.0 111.385 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -79.25 157.79 27.71 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.364 -1.46 . . . . 0.0 111.082 177.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.32 -32.74 57.36 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.456 0.702 . . . . 0.0 112.567 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.0 tp -65.98 -39.65 90.53 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.197 0.599 . . . . 0.0 111.887 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 29.6 t -60.9 -45.06 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 1.7 mm -61.6 -44.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.349 0.66 . . . . 0.0 110.639 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.71 -54.92 38.34 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 125.028 1.331 . . . . 0.0 110.028 -177.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.55 -33.41 75.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.216 0.606 . . . . 0.0 112.067 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.05 -25.16 64.32 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.4 mt -89.5 -12.06 41.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.209 1.404 . . . . 0.0 113.097 169.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.9 9.25 59.85 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 125.174 1.369 . . . . 0.0 114.276 -177.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.7 mmt -83.37 172.72 12.21 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.035 1.734 . . . . 0.0 111.06 174.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -107.96 -28.96 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -169.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.5 p -132.15 152.71 51.12 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.952 1.301 . . . . 0.0 111.739 -171.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.2 -29.77 65.94 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.99 0.916 . . . . 0.0 112.614 171.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -67.54 -23.69 65.46 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 127.231 2.213 . . . . 0.0 114.696 174.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -70.35 -28.65 65.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.792 0.724 . . . . 0.0 110.879 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -100.79 -31.51 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.276 0.63 . . . . 0.0 112.336 -171.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.42 -40.75 5.71 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.027 1.731 . . . . 0.0 113.021 -176.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -45.5 77.2 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.579 1.152 . . . . 0.0 112.852 175.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.98 -40.95 60.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.231 1.012 . . . . 0.0 112.012 174.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.0 -52.8 62.54 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.557 0.743 . . . . 0.0 112.173 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.04 -34.62 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.68 -0.637 . . . . 0.0 111.343 177.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -57.91 -48.06 81.0 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.45 0.3 . . . . 0.0 110.261 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -64.08 -35.6 81.28 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 124.325 1.05 . . . . 0.0 111.515 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -64.75 -37.12 86.54 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.983 -1.073 . . . . 0.0 113.689 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.1 t -71.55 -18.13 62.27 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -113.73 15.4 18.76 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.408 1.632 . . . . 0.0 115.408 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.64 39.27 0.89 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.502 1.521 . . . . 0.0 113.981 175.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.16 -32.63 3.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.177 1.791 . . . . 0.0 113.099 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.1 mt -128.53 163.81 24.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.641 1.11 . . . . 0.0 113.665 176.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -148.79 115.24 5.89 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.795 2.038 . . . . 0.0 108.959 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -89.62 140.9 29.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.649 0.738 . . . . 0.0 111.76 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -102.05 107.0 17.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 126.259 1.823 . . . . 0.0 107.382 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.4 -8.88 20.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.089 1.356 . . . . 0.0 112.868 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -66.09 -32.83 74.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.68 1.992 . . . . 0.0 112.283 177.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.13 16.7 0.84 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 173.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.1 mptt 50.22 39.93 20.96 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.345 2.258 . . . . 0.0 113.384 -170.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.84 118.27 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.383 0.673 . . . . 0.0 109.866 174.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -83.4 127.05 33.37 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.333 1.453 . . . . 0.0 111.428 173.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -132.81 129.54 38.66 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.859 1.664 . . . . 0.0 108.494 -174.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.39 129.52 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.497 -1.377 . . . . 0.0 111.301 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.1 88.01 0.41 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.046 1.338 . . . . 0.0 112.187 -177.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.845 2.058 . . . . 0.0 113.519 176.455 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.4 m . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -129.28 160.08 34.12 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.462 1.505 . . . . 0.0 111.995 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 15.7 tpt -68.36 138.19 55.2 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.842 0.857 . . . . 0.0 111.744 177.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.44 150.62 25.93 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.327 1.051 . . . . 0.0 112.908 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 60.4 p 63.07 146.89 0.09 OUTLIER Pre-proline 0 N--CA 1.481 1.117 0 C-N-CA 128.639 2.775 . . . . 0.0 116.512 -177.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -81.04 173.46 11.88 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 124.169 3.246 . . . . 0.0 112.572 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -124.28 109.27 13.16 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.14 1.376 . . . . 0.0 111.84 172.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -90.11 144.7 25.65 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.243 1.017 . . . . 0.0 112.099 175.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 6.4 m -92.52 -23.95 18.93 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.65 1.18 . . . . 0.0 114.105 173.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -153.24 167.48 29.18 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.9 0.88 . . . . 0.0 113.287 178.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -46.66 -42.72 16.82 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.997 1.719 . . . . 0.0 113.005 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 -62.86 -45.4 92.74 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.73 0.695 . . . . 0.0 112.599 -179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -62.32 -45.78 91.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.291 0.567 . . . . 0.0 111.521 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.22 -48.93 75.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.718 0.807 . . . . 0.0 112.459 171.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.8 -46.21 88.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.005 0.922 . . . . 0.0 112.384 175.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 39.9 mt -57.73 -50.09 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 124.585 1.154 . . . . 0.0 110.948 179.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -65.09 -50.99 63.98 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.026 0.531 . . . . 0.0 110.893 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -56.7 -45.56 81.75 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.522 1.129 . . . . 0.0 111.968 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -58.44 -54.3 48.55 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.138 0.975 . . . . 0.0 111.434 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.4 mt -70.53 -18.9 62.94 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.861 -1.149 . . . . 0.0 113.359 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -74.34 -36.33 63.64 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.829 0.74 . . . . 0.0 111.423 169.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -81.77 -38.63 25.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.418 0.687 . . . . 0.0 112.322 -173.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.98 -29.03 12.78 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.66 -168.85 24.1 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -171.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -63.22 127.81 21.09 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.166 3.244 . . . . 0.0 114.126 -171.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -141.41 162.68 34.89 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.234 1.414 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -79.32 161.38 26.29 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 120.153 -1.592 . . . . 0.0 112.503 178.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . 0.403 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.05 -32.39 64.01 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.244 0.618 . . . . 0.0 112.413 -179.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.6 tp -65.09 -41.58 94.88 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.789 -0.569 . . . . 0.0 111.365 177.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.5 t -59.34 -45.06 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.971 0.508 . . . . 0.0 109.896 174.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.403 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -63.73 -43.0 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.758 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.85 -54.78 40.33 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.13 1.372 . . . . 0.0 110.06 -178.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -63.93 -34.55 78.22 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.251 0.62 . . . . 0.0 111.939 -179.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.46 64.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 177.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.6 mt -88.48 -11.88 44.6 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.567 1.547 . . . . 0.0 113.256 170.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.99 10.86 60.81 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.697 1.141 . . . . 0.0 114.144 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.0 mmt -83.47 175.32 9.89 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.988 1.715 . . . . 0.0 110.859 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -107.8 -34.62 6.9 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -171.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 63.0 p -132.45 156.78 46.12 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.584 1.154 . . . . 0.0 112.181 -171.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.17 66.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 113.732 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.95 -29.73 69.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.913 1.285 . . . . 0.0 113.773 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -67.2 -23.97 65.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.861 0.362 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.77 -30.93 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.98 0.912 . . . . 0.0 112.598 -176.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.89 -40.62 14.4 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.326 1.45 . . . . 0.0 112.747 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -44.34 77.94 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.495 1.118 . . . . 0.0 112.744 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.64 -42.8 60.92 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.807 1.243 . . . . 0.0 111.814 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.2 mt -62.44 -51.52 67.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.981 0.913 . . . . 0.0 112.306 -176.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.68 -34.56 78.13 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.27 0.628 . . . . 0.0 110.792 178.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 83.1 mtt-85 -65.64 -37.26 86.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.492 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.7 mtp -68.83 -34.05 74.85 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.066 0.946 . . . . 0.0 111.874 173.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.5 tttp -64.09 -38.66 91.86 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.581 -1.324 . . . . 0.0 112.803 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.95 -14.61 62.79 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 175.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -114.08 14.83 18.39 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 175.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 72.06 38.51 0.89 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.363 1.465 . . . . 0.0 113.417 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -120.39 -32.86 4.0 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.767 1.627 . . . . 0.0 113.19 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 10.9 mt -128.08 163.44 24.6 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 176.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -150.23 115.37 5.39 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.165 1.786 . . . . 0.0 109.788 177.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 48.9 ttp -84.09 145.97 28.16 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.802 -0.561 . . . . 0.0 111.8 174.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -96.15 127.47 42.19 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 125.239 1.415 . . . . 0.0 109.135 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -71.14 -13.83 62.08 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.178 -0.951 . . . . 0.0 112.377 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -83.82 -37.34 22.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.678 1.191 . . . . 0.0 113.251 -169.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 6.3 t -134.16 8.11 3.71 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.196 1.398 . . . . 0.0 112.629 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm 51.53 40.18 26.38 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 127.053 2.141 . . . . 0.0 113.328 -170.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.31 120.38 28.54 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.612 -177.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -82.09 124.81 30.17 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.528 1.131 . . . . 0.0 110.801 172.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.5 p -130.36 128.0 40.54 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 108.465 -173.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.37 128.62 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 120.466 -1.397 . . . . 0.0 110.9 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -67.43 90.35 0.24 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.797 1.239 . . . . 0.0 111.89 -178.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 126.853 2.061 . . . . 0.0 112.475 179.012 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 41.7 m . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -74.89 -35.31 62.28 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.742 0.817 . . . . 0.0 113.009 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 14.3 tpt -142.38 126.16 17.05 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.135 1.374 . . . . 0.0 111.078 177.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 58.13 166.58 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 127.757 2.423 . . . . 0.0 116.867 178.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.455 ' H ' ' HD2' ' A' ' 103' ' ' PRO . 65.3 m -107.18 -51.95 0.09 OUTLIER Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 125.766 1.627 . . . . 0.0 112.446 170.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.455 ' HD2' ' H ' ' A' ' 102' ' ' SER . 69.2 Cg_endo -73.0 176.21 9.4 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.981 2.454 . . . . 0.0 111.747 169.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -123.95 109.06 13.08 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.496 1.118 . . . . 0.0 111.556 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -94.9 140.2 30.27 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.532 1.133 . . . . 0.0 111.549 173.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.8 m -86.27 -24.64 25.88 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 174.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -153.73 167.43 29.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.064 0.946 . . . . 0.0 113.046 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -47.47 -42.4 22.68 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.929 1.692 . . . . 0.0 113.012 177.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -61.64 -46.25 90.58 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 118.684 0.674 . . . . 0.0 112.418 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -62.28 -45.69 92.13 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.708 0.803 . . . . 0.0 111.39 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.41 -48.55 76.71 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.912 0.885 . . . . 0.0 112.971 170.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.46 -44.41 95.89 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.061 0.944 . . . . 0.0 112.595 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 32.9 mt -57.97 -49.52 80.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 124.751 1.22 . . . . 0.0 110.799 178.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -64.28 -50.05 69.43 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.071 0.548 . . . . 0.0 110.711 -177.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -54.58 -51.42 65.34 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.188 0.995 . . . . 0.0 111.971 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -54.56 -52.0 63.45 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 123.851 0.86 . . . . 0.0 111.538 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.32 -19.89 61.58 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.943 -1.098 . . . . 0.0 113.004 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -73.05 -34.27 66.18 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.846 0.858 . . . . 0.0 110.704 169.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.63 -39.0 20.82 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.972 0.909 . . . . 0.0 111.706 -170.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.93 -27.93 11.87 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 176.001 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 98.49 -169.81 23.88 Favored Glycine 0 N--CA 1.474 1.186 0 CA-C-O 118.785 -1.008 . . . . 0.0 110.644 -171.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -61.5 129.53 28.42 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.985 3.124 . . . . 0.0 114.122 -171.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -139.76 164.82 28.94 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.304 1.442 . . . . 0.0 110.785 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.12 158.29 26.42 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.33 -1.481 . . . . 0.0 111.068 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.13 -33.2 57.23 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.445 0.698 . . . . 0.0 112.605 -178.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.88 -39.93 91.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.178 0.591 . . . . 0.0 111.848 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.0 t -60.31 -45.91 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.1 mm -61.05 -43.4 96.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.364 0.665 . . . . 0.0 110.528 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.42 -54.33 48.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.636 1.175 . . . . 0.0 110.077 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -65.28 -33.16 75.32 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.987 0.515 . . . . 0.0 112.061 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.93 -25.71 64.71 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.0 mt -88.6 -11.27 45.97 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.249 1.419 . . . . 0.0 113.319 169.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.84 11.54 61.65 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.762 1.172 . . . . 0.0 114.236 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.2 mtt -80.52 176.21 9.99 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.007 1.723 . . . . 0.0 111.211 171.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -108.14 -35.96 6.43 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.4 p -125.64 152.2 45.5 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.024 1.33 . . . . 0.0 112.312 -170.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.12 -29.09 68.39 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -64.13 -28.58 69.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.935 2.094 . . . . 0.0 114.453 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -72.26 -20.62 61.5 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.822 0.737 . . . . 0.0 111.439 177.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -105.48 -30.57 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.539 -0.725 . . . . 0.0 112.651 -177.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.07 -40.28 31.06 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.379 1.472 . . . . 0.0 112.389 -173.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -52.38 -50.17 62.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.682 1.193 . . . . 0.0 111.817 173.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -71.15 -41.76 70.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.009 1.324 . . . . 0.0 111.654 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.03 -52.9 61.06 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.109 0.963 . . . . 0.0 111.916 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -33.04 74.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.776 0.83 . . . . 0.0 111.302 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 48.0 mtp85 -61.52 -43.07 99.53 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.923 174.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.1 mtp -69.71 -33.18 72.15 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.997 0.919 . . . . 0.0 111.809 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -62.8 -42.23 99.62 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.488 -1.382 . . . . 0.0 112.408 170.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.9 m -69.18 -13.85 62.65 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 178.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -114.08 14.89 18.39 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 72.77 38.46 0.75 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.361 1.464 . . . . 0.0 113.588 176.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.1 mp -121.51 -31.9 3.94 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.731 1.612 . . . . 0.0 113.368 -178.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 10.0 mt -127.35 164.19 22.34 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -148.38 115.84 6.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.809 1.643 . . . . 0.0 110.259 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -86.15 144.27 27.58 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.343 -0.848 . . . . 0.0 112.034 174.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.37 130.61 34.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.71 1.204 . . . . 0.0 109.236 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -73.82 -9.34 58.55 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 124.679 1.192 . . . . 0.0 112.878 176.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -90.79 -39.1 12.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -174.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.64 15.12 2.34 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.72 40.84 31.11 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 126.162 1.785 . . . . 0.0 113.045 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.42 117.35 23.58 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.47 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.52 122.32 28.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.197 0.999 . . . . 0.0 110.637 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.46 131.17 51.72 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 125.513 1.525 . . . . 0.0 108.434 -178.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -52.23 133.33 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.115 -0.991 . . . . 0.0 110.702 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -70.26 102.12 2.05 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 111.193 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.707 2.003 . . . . 0.0 112.758 173.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.554 0.216 . . . . 0.0 111.474 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -72.69 149.7 43.58 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.698 1.199 . . . . 0.0 112.639 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.65 11.83 31.9 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -174.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -140.14 161.83 36.69 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.514 1.525 . . . . 0.0 112.227 175.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.413 ' H ' ' HD2' ' A' ' 103' ' ' PRO . 31.8 t -121.65 -53.12 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 125.116 1.366 . . . . 0.0 114.292 -177.147 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.413 ' HD2' ' H ' ' A' ' 102' ' ' SER . 61.2 Cg_endo -74.44 172.95 15.1 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 122.335 2.023 . . . . 0.0 112.617 175.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -123.84 117.52 25.05 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.737 1.615 . . . . 0.0 110.339 174.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -90.71 143.15 27.02 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.813 0.845 . . . . 0.0 112.833 -176.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 6.5 t -86.31 -25.72 25.29 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.044 1.338 . . . . 0.0 112.891 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -149.69 165.15 33.22 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.877 1.271 . . . . 0.0 112.296 176.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.28 -33.05 62.89 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.851 1.26 . . . . 0.0 113.091 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 -65.29 -49.92 67.7 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.03 0.832 . . . . 0.0 111.7 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -53.87 -48.65 69.82 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.873 0.76 . . . . 0.0 112.061 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.56 -51.25 70.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.018 0.927 . . . . 0.0 112.155 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.09 -42.33 99.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 118.589 -0.72 . . . . 0.0 112.262 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 49.5 mt -57.75 -51.31 71.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.66 1.118 . . . . 0.0 111.256 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -65.26 -49.3 70.14 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.124 0.57 . . . . 0.0 110.423 -176.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.7 tpt85 -58.59 -43.86 89.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.559 1.144 . . . . 0.0 112.825 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -60.75 -53.85 52.33 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 124.756 1.222 . . . . 0.0 111.558 175.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.21 -19.54 63.96 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.957 -1.089 . . . . 0.0 112.705 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -73.84 -35.48 64.82 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.729 0.695 . . . . 0.0 111.482 169.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -77.72 -41.37 38.09 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.158 0.583 . . . . 0.0 111.957 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.58 -28.01 11.99 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -178.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.29 -166.7 24.51 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -172.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -62.97 125.91 16.91 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.896 3.064 . . . . 0.0 114.124 -169.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -139.13 162.24 35.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.205 1.402 . . . . 0.0 110.973 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -81.12 160.25 24.48 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.282 -1.511 . . . . 0.0 112.032 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.2 -32.8 62.51 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.6 0.636 . . . . 0.0 112.522 -177.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.7 tp -65.74 -40.87 92.59 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.957 -0.464 . . . . 0.0 111.493 177.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.1 t -59.14 -46.35 92.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.169 0.587 . . . . 0.0 109.638 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.1 mm -62.26 -43.36 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.834 0.853 . . . . 0.0 110.547 -179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -58.06 -53.88 53.23 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.504 1.121 . . . . 0.0 110.185 -178.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.04 -34.31 77.73 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.072 0.549 . . . . 0.0 111.984 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.91 -26.33 65.93 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.422 0.689 . . . . 0.0 112.833 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.1 mt -86.35 -11.94 50.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.658 1.583 . . . . 0.0 113.19 169.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.94 11.15 61.95 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.831 1.205 . . . . 0.0 113.801 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 29.2 mtt -80.86 176.91 9.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.508 1.923 . . . . 0.0 111.228 173.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -108.04 -37.35 6.09 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -176.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -128.29 155.02 45.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.593 1.157 . . . . 0.0 112.52 -170.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.76 -24.94 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.31 1.044 . . . . 0.0 113.464 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.08 -28.91 68.57 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.728 1.211 . . . . 0.0 113.324 174.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -72.77 -15.66 61.65 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 118.383 0.538 . . . . 0.0 112.267 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -108.57 -31.06 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.017 0.927 . . . . 0.0 113.001 178.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.56 -41.11 53.81 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.07 1.348 . . . . 0.0 112.376 -172.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -55.4 -41.58 72.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.212 1.005 . . . . 0.0 112.639 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.51 -46.71 25.43 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.313 1.045 . . . . 0.0 111.49 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 84.2 mt -57.09 -51.94 67.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.493 1.117 . . . . 0.0 112.333 -178.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 -35.13 77.57 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.071 0.548 . . . . 0.0 111.247 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -64.43 -40.51 95.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 118.467 -0.777 . . . . 0.0 110.767 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 87.5 mtp -66.14 -34.8 78.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.673 1.189 . . . . 0.0 111.419 175.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.3 tttm -63.66 -40.28 96.45 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.531 -1.356 . . . . 0.0 113.112 169.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.69 -14.12 62.64 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 175.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -114.11 14.7 18.32 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 176.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.5 t-80 72.11 37.84 0.95 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.531 1.533 . . . . 0.0 113.624 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -120.09 -32.61 4.14 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.657 1.583 . . . . 0.0 113.099 -179.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -127.92 164.08 23.06 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -148.79 115.41 5.94 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.972 2.109 . . . . 0.0 109.178 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.5 ttp -88.8 144.03 26.51 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.569 -0.707 . . . . 0.0 112.147 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.94 129.78 37.83 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.446 1.498 . . . . 0.0 110.102 171.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -74.16 -7.3 52.15 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 123.975 0.91 . . . . 0.0 113.147 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.87 -35.93 21.89 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.657 0.783 . . . . 0.0 112.865 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 2.1 t -144.47 15.77 1.64 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt 54.27 39.44 30.84 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.094 1.757 . . . . 0.0 113.306 -171.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -82.34 119.0 23.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.387 0.675 . . . . 0.0 109.857 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -86.18 123.19 31.19 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.025 1.33 . . . . 0.0 110.601 175.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -126.95 129.03 47.35 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 125.709 1.604 . . . . 0.0 108.083 -176.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.76 129.79 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 120.851 -1.155 . . . . 0.0 110.474 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.51 91.07 0.56 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.432 1.093 . . . . 0.0 111.255 -179.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 126.615 1.966 . . . . 0.0 112.056 177.86 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 N--CA 1.487 1.39 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 62.37 166.91 0.12 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 127.277 2.231 . . . . 0.0 115.292 -177.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 15.5 tpt -81.29 145.0 31.12 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.715 1.206 . . . . 0.0 112.312 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -144.53 143.3 30.77 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.325 1.45 . . . . 0.0 111.392 172.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 40.4 m -76.96 -48.0 2.69 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -176.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.72 169.6 18.02 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.816 2.344 . . . . 0.0 112.315 178.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -124.33 112.25 16.75 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.446 1.498 . . . . 0.0 111.702 175.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -99.46 148.1 24.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.754 1.222 . . . . 0.0 112.86 172.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.5 t -100.28 -29.15 12.6 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.46 1.904 . . . . 0.0 112.544 176.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -149.26 163.56 37.33 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.882 1.273 . . . . 0.0 112.708 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.19 -34.88 61.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.917 1.287 . . . . 0.0 113.34 -177.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -62.0 -46.67 88.18 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 118.689 0.677 . . . . 0.0 111.321 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -61.36 -49.24 77.75 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.664 1.185 . . . . 0.0 112.389 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.64 -46.7 73.99 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.629 1.172 . . . . 0.0 112.484 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.01 -43.73 94.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.793 173.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 42.0 mt -56.7 -49.66 77.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.679 1.127 . . . . 0.0 111.446 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -64.14 -53.17 53.78 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.017 0.527 . . . . 0.0 110.61 -177.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.2 ttp85 -57.75 -42.61 84.32 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.862 1.265 . . . . 0.0 113.019 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -58.95 -54.03 51.73 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.288 1.035 . . . . 0.0 111.462 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.55 -18.81 62.92 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.75 -1.219 . . . . 0.0 113.137 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -73.04 -35.01 66.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 110.924 169.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.34 -39.26 17.85 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.405 0.682 . . . . 0.0 112.438 -172.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.59 -26.44 13.83 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.82 -167.4 26.85 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -173.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -62.49 126.23 17.94 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.947 3.098 . . . . 0.0 113.821 -170.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -139.33 162.6 34.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.035 1.334 . . . . 0.0 110.857 179.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 54.3 mtt85 -80.69 159.75 25.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.36 -1.463 . . . . 0.0 111.955 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -54.72 -33.11 60.63 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.35 0.66 . . . . 0.0 112.552 -177.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.01 -41.9 94.94 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.971 -0.456 . . . . 0.0 111.582 177.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.0 -45.78 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.238 0.615 . . . . 0.0 109.691 174.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 2.0 mm -61.92 -44.29 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 123.783 0.833 . . . . 0.0 110.344 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -56.8 -54.39 46.96 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.924 1.29 . . . . 0.0 110.194 -177.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -63.47 -34.44 77.76 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.357 0.663 . . . . 0.0 112.007 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.37 -24.73 63.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 4.3 mt -88.9 -11.83 43.45 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.642 1.577 . . . . 0.0 113.428 170.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.54 11.3 58.33 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.106 1.336 . . . . 0.0 113.991 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 30.5 mtt -81.33 177.03 9.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 111.29 173.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.94 -36.6 6.31 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 64.2 p -131.54 155.79 46.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.736 1.214 . . . . 0.0 112.572 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.57 -28.6 67.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.469 1.108 . . . . 0.0 113.523 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -66.09 -28.39 68.78 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 113.197 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -73.46 -15.34 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -108.11 -30.83 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.532 1.133 . . . . 0.0 113.192 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.95 -40.71 31.41 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.283 1.433 . . . . 0.0 112.406 -173.083 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -54.82 -40.86 70.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.511 1.124 . . . . 0.0 112.989 175.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -77.23 -46.46 23.14 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 176.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.48 -51.77 68.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.394 1.077 . . . . 0.0 112.127 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -33.14 74.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.636 0.774 . . . . 0.0 111.621 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.3 mtp-105 -70.17 -32.28 70.15 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.963 -0.46 . . . . 0.0 112.152 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -73.68 -34.09 64.72 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.663 1.185 . . . . 0.0 111.458 171.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -62.67 -42.52 99.66 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.236 -1.54 . . . . 0.0 112.047 171.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.1 m -67.05 -13.58 62.06 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -113.97 14.93 18.54 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 176.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.03 38.4 0.91 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.667 1.587 . . . . 0.0 112.94 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 5.4 mp -121.52 -32.48 3.82 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.636 1.174 . . . . 0.0 113.752 -179.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -123.89 164.65 18.84 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.158 0.983 . . . . 0.0 113.227 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.2 115.38 5.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.799 2.04 . . . . 0.0 108.854 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.1 ttp -88.43 143.52 26.94 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.708 -0.62 . . . . 0.0 111.9 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -90.21 130.77 36.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.018 1.327 . . . . 0.0 109.841 171.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.65 -9.12 58.34 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 123.899 0.88 . . . . 0.0 113.014 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -86.45 -36.46 19.07 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -172.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.9 t -143.09 15.86 1.9 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.049 0.94 . . . . 0.0 113.488 176.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 54.0 40.6 31.77 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.12 1.768 . . . . 0.0 113.307 -172.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.92 119.96 25.52 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.591 0.757 . . . . 0.0 109.875 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -86.09 123.82 31.82 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.06 1.344 . . . . 0.0 110.824 174.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -128.33 130.24 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.706 1.602 . . . . 0.0 108.743 -175.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.81 126.43 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 120.756 -1.215 . . . . 0.0 110.598 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.89 95.62 0.26 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.146 . . . . 0.0 112.48 -177.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.199 2.6 . . . . 0.0 113.559 171.192 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 48.6 mtt180 . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -59.43 -45.65 90.98 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.72 1.208 . . . . 0.0 111.839 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -58.3 -43.61 88.18 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.452 1.101 . . . . 0.0 112.786 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.67 -42.74 86.09 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.207 -0.933 . . . . 0.0 112.944 173.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.542 HD11 HG12 ' A' ' 140' ' ' VAL . 27.3 mt -55.52 -49.28 74.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.44 -53.56 50.39 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.176 0.59 . . . . 0.0 110.752 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -56.01 -44.36 78.6 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.967 1.307 . . . . 0.0 113.493 178.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -58.89 -54.22 49.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.389 1.076 . . . . 0.0 111.237 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.87 -18.96 62.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.821 -1.174 . . . . 0.0 113.187 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -73.36 -36.26 66.08 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.812 0.845 . . . . 0.0 111.294 169.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.46 -39.24 20.79 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.412 0.685 . . . . 0.0 112.408 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.05 -28.39 13.08 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.93 -168.74 24.91 Favored Glycine 0 N--CA 1.469 0.9 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 -172.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.433 ' HB3' HG22 ' A' ' 163' ' ' THR . 47.7 Cg_endo -62.96 128.26 22.56 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 124.004 3.136 . . . . 0.0 113.842 -170.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -139.97 163.17 33.39 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.07 1.348 . . . . 0.0 111.053 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -80.5 159.29 25.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.364 -1.46 . . . . 0.0 111.51 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.511 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.58 -33.52 60.41 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.558 0.743 . . . . 0.0 112.505 -177.279 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.25 -41.05 94.68 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.265 0.626 . . . . 0.0 111.627 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.6 t -59.44 -45.82 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.431 0.692 . . . . 0.0 109.154 174.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.511 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.99 -43.26 97.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.492 0.717 . . . . 0.0 110.67 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.553 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.46 -54.54 45.63 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.718 1.207 . . . . 0.0 110.044 -177.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -63.87 -34.61 78.32 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.325 0.65 . . . . 0.0 111.974 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.67 -25.39 64.78 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 113' ' ' ILE . 3.7 mt -89.36 -11.98 41.76 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.475 1.51 . . . . 0.0 113.437 170.055 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.7 11.46 59.17 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.674 1.13 . . . . 0.0 114.204 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.1 mtt -80.08 176.88 9.35 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.043 1.737 . . . . 0.0 110.982 171.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -107.96 -38.14 5.89 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -175.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 60.0 p -129.33 155.75 45.12 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.347 -170.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.52 -28.07 66.74 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.53 -27.6 67.11 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.77 1.228 . . . . 0.0 113.472 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.17 -22.47 62.96 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.301 0.5 . . . . 0.0 111.457 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.553 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -103.25 -30.31 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 O-C-N 121.634 -0.667 . . . . 0.0 112.693 -177.756 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.41 -39.51 32.96 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.265 1.426 . . . . 0.0 112.498 -172.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -53.49 -49.82 66.69 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.272 1.029 . . . . 0.0 111.823 173.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -70.37 -42.25 72.05 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.006 1.322 . . . . 0.0 111.666 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.93 -52.87 61.37 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.843 0.857 . . . . 0.0 111.983 -177.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -33.23 75.01 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.433 0.693 . . . . 0.0 111.087 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.4 mtp85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.053 0.388 . . . . 0.0 110.887 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.94 -32.73 71.15 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.157 0.983 . . . . 0.0 111.939 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -64.45 -39.43 93.8 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.464 -1.398 . . . . 0.0 112.918 169.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.5 t -68.35 -14.37 62.94 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -115.53 15.99 16.61 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 115.853 1.797 . . . . 0.0 115.853 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.85 38.51 0.93 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.465 1.506 . . . . 0.0 113.162 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 6.6 mp -121.22 -32.26 3.93 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.507 1.523 . . . . 0.0 113.391 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.472 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -126.8 163.42 23.61 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.163 0.892 . . . . 0.0 113.057 175.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -148.35 117.45 6.82 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.007 1.723 . . . . 0.0 109.187 176.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -85.31 143.03 28.93 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.98 -0.45 . . . . 0.0 111.416 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -87.1 131.04 34.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.966 1.306 . . . . 0.0 109.413 170.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -70.96 -14.59 62.42 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.977 0.911 . . . . 0.0 112.365 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -83.33 -40.79 19.02 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.659 0.783 . . . . 0.0 112.604 -170.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.2 t -138.93 15.21 2.66 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.506 1.122 . . . . 0.0 113.703 178.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 53.1 40.65 31.57 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.404 1.481 . . . . 0.0 112.813 -174.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.52 119.13 24.82 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.453 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -84.68 124.87 31.98 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.59 1.156 . . . . 0.0 110.925 175.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.0 OUTLIER -130.83 129.2 42.05 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.58 1.552 . . . . 0.0 108.542 -174.277 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.56 127.82 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 120.707 -1.245 . . . . 0.0 110.788 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -66.88 91.65 0.21 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.771 1.228 . . . . 0.0 112.41 -176.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 . . . . . 0 C--O 1.255 1.358 0 C-N-CA 128.484 2.713 . . . . 0.0 113.379 176.146 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 . . . . . 0 N--CA 1.475 0.811 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -64.59 -42.71 95.42 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.173 0.989 . . . . 0.0 110.311 -177.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -62.53 -49.4 75.5 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.953 0.901 . . . . 0.0 112.002 171.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.54 -45.95 84.47 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.822 0.849 . . . . 0.0 112.52 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 140' ' ' VAL . 29.3 mt -59.84 -50.18 81.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.213 1.005 . . . . 0.0 110.86 179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -64.71 -48.33 75.05 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.842 0.457 . . . . 0.0 110.813 -177.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.4 tpt85 -58.7 -44.58 90.36 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.924 1.29 . . . . 0.0 112.773 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.93 -52.99 62.7 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.678 1.191 . . . . 0.0 111.55 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.77 -19.33 63.51 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.99 -1.069 . . . . 0.0 112.648 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -72.89 -34.74 66.87 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.443 0.697 . . . . 0.0 110.82 169.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.81 -41.38 26.57 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.216 0.607 . . . . 0.0 112.098 -173.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -27.95 12.37 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.41 -167.43 24.78 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.316 -1.113 . . . . 0.0 110.316 -171.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -64.86 127.74 19.3 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.68 2.92 . . . . 0.0 114.322 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -139.42 163.25 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.446 1.499 . . . . 0.0 110.889 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -81.14 162.31 23.72 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 120.172 -1.58 . . . . 0.0 112.46 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.516 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.05 -32.04 63.7 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.364 0.666 . . . . 0.0 112.649 -178.568 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.55 -41.14 89.11 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.939 -0.475 . . . . 0.0 111.41 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.86 -45.38 91.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.976 0.511 . . . . 0.0 109.768 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.516 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -64.0 -42.65 96.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.629 0.772 . . . . 0.0 110.686 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.467 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.96 -54.44 44.79 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.713 1.205 . . . . 0.0 110.002 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -64.28 -33.85 76.77 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.222 0.609 . . . . 0.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.74 -24.77 63.59 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.094 0.775 . . . . 0.0 113.094 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.2 mt -89.66 -11.94 41.03 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.351 1.46 . . . . 0.0 113.118 169.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.93 11.05 60.68 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.781 1.181 . . . . 0.0 114.136 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.06 174.98 10.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.915 1.686 . . . . 0.0 110.803 172.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -107.79 -33.97 7.1 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.3 p -133.42 156.25 48.04 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.587 1.155 . . . . 0.0 112.239 -171.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.13 -27.94 66.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.376 1.07 . . . . 0.0 113.581 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.46 -26.38 65.47 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.982 1.313 . . . . 0.0 113.702 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -69.04 -24.1 64.14 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.424 0.556 . . . . 0.0 111.345 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.533 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.25 -30.95 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 123.868 0.867 . . . . 0.0 112.659 -174.765 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.99 -41.1 15.71 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 125.325 1.45 . . . . 0.0 112.408 -175.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.17 -44.08 71.18 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.541 1.137 . . . . 0.0 112.9 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.02 -43.17 55.24 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.628 1.171 . . . . 0.0 112.135 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -62.45 -51.81 66.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.72 0.808 . . . . 0.0 112.313 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -34.4 77.59 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.669 0.788 . . . . 0.0 110.903 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 2.4 mtm105 -61.39 -44.16 97.62 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.007 0.367 . . . . 0.0 110.595 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.76 -34.56 78.61 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.907 0.883 . . . . 0.0 111.394 177.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -65.29 -37.64 87.77 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.849 -1.157 . . . . 0.0 113.503 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.67 -18.52 63.57 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -113.72 15.71 18.71 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.32 39.22 0.96 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.451 1.501 . . . . 0.0 113.965 174.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.96 -32.11 3.79 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.228 1.811 . . . . 0.0 113.246 -178.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.444 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.7 mt -129.31 164.28 23.87 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.417 1.008 . . . . 0.0 113.47 176.491 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -148.85 118.23 6.9 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.52 1.928 . . . . 0.0 109.505 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -87.67 142.48 27.8 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.964 -1.085 . . . . 0.0 112.154 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.01 116.12 31.39 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 126.193 1.797 . . . . 0.0 108.001 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.42 -6.92 39.17 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.916 0.887 . . . . 0.0 112.693 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.7 mp0 -69.44 -33.78 73.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.407 1.883 . . . . 0.0 112.444 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 4.4 t -148.83 14.53 0.93 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.059 1.344 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 51.35 35.88 14.99 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 127.68 2.392 . . . . 0.0 113.28 -169.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.45 119.55 25.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.677 0.791 . . . . 0.0 110.35 -174.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -82.3 121.75 27.06 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.926 1.29 . . . . 0.0 111.091 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.75 133.6 54.92 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.164 1.786 . . . . 0.0 109.506 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.35 127.41 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.451 -1.406 . . . . 0.0 110.476 174.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.43 92.75 0.21 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.646 1.179 . . . . 0.0 111.838 -177.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.274 0 C-N-CA 127.539 2.336 . . . . 0.0 112.001 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -64.27 -39.13 93.3 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.777 0.831 . . . . 0.0 109.699 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -65.15 -51.7 59.58 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.972 0.509 . . . . 0.0 111.909 169.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.27 88.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.698 0.681 . . . . 0.0 111.891 -178.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.51 HD11 HG12 ' A' ' 140' ' ' VAL . 30.2 mt -58.34 -53.47 45.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.174 0.99 . . . . 0.0 110.643 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -61.42 -48.66 80.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.876 0.369 . . . . 0.0 111.256 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -64.32 -42.88 96.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.572 1.549 . . . . 0.0 112.427 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -60.57 -45.04 95.39 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.793 0.837 . . . . 0.0 112.4 174.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.409 ' CD1' HD21 ' A' ' 153' ' ' LEU . 82.7 mt -75.25 -25.5 58.11 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 121.355 -0.841 . . . . 0.0 112.725 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -69.12 -40.88 78.04 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.275 1.03 . . . . 0.0 110.4 169.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -75.39 -42.37 53.97 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -109.33 -16.98 13.91 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -173.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 100.89 -168.32 20.26 Favored Glycine 0 N--CA 1.466 0.67 0 C-N-CA 125.101 1.334 . . . . 0.0 110.557 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -63.09 127.37 20.07 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.757 2.305 . . . . 0.0 112.004 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -136.77 163.35 30.83 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.686 1.194 . . . . 0.0 110.712 176.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.4 mtt85 -80.79 160.48 24.85 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 120.194 -1.566 . . . . 0.0 111.726 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.528 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.94 -31.99 63.42 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -176.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.5 tp -65.62 -42.06 92.0 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.709 0.404 . . . . 0.0 111.31 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.27 -45.18 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.07 0.548 . . . . 0.0 109.575 174.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.528 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -63.38 -42.22 95.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 123.603 0.761 . . . . 0.0 110.542 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.452 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.44 -54.27 45.85 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.601 1.16 . . . . 0.0 109.827 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -65.64 -33.5 76.05 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.051 0.54 . . . . 0.0 112.138 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.27 -24.41 64.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.674 0.789 . . . . 0.0 112.87 176.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.41 HD11 HG13 ' A' ' 113' ' ' ILE . 3.2 mt -90.96 -11.96 37.4 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.064 1.745 . . . . 0.0 113.472 170.064 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.16 10.88 61.94 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.696 1.141 . . . . 0.0 114.307 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.24 175.72 9.7 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.017 1.727 . . . . 0.0 110.807 172.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -106.48 -35.01 7.21 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -134.16 156.99 47.35 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.431 1.092 . . . . 0.0 112.445 -170.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.5 -27.32 64.35 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.423 1.089 . . . . 0.0 113.7 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.42 -22.57 61.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.679 1.591 . . . . 0.0 114.129 176.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -70.86 -25.83 62.99 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.693 0.678 . . . . 0.0 111.14 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.51 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -104.85 -31.47 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.986 0.914 . . . . 0.0 112.692 -173.054 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -46.71 -38.23 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.559 1.544 . . . . 0.0 113.224 -175.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.38 -50.07 70.69 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.284 1.433 . . . . 0.0 112.107 174.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' ASP . . . . . 0.413 ' HB3' HD12 ' A' ' 113' ' ' ILE . 8.9 m-20 -70.1 -41.29 74.22 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.828 1.251 . . . . 0.0 111.601 176.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.07 -53.35 51.16 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.332 0.653 . . . . 0.0 112.276 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.4 -31.72 72.13 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.647 0.779 . . . . 0.0 111.106 177.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -60.16 -47.77 84.55 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.184 0.447 . . . . 0.0 110.489 172.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.3 mtp -64.9 -34.32 78.12 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.198 0.999 . . . . 0.0 111.368 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -63.77 -40.57 97.01 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.868 -1.145 . . . . 0.0 113.038 170.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.5 m -72.24 -13.74 61.6 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -113.91 14.98 18.62 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 174.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 72.02 39.21 0.83 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.541 1.537 . . . . 0.0 114.038 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.38 -31.57 3.78 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.118 1.767 . . . . 0.0 113.366 -178.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.477 HD11 ' CG2' ' A' ' 113' ' ' ILE . 12.5 mt -128.77 163.66 24.7 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.71 1.141 . . . . 0.0 113.967 176.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -148.08 121.59 9.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.367 1.867 . . . . 0.0 109.424 175.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 46.6 ttp -90.35 145.81 24.67 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.293 -0.88 . . . . 0.0 112.427 173.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -93.23 128.32 39.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.162 1.385 . . . . 0.0 109.053 170.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.64 -14.47 62.49 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 121.19 -0.944 . . . . 0.0 112.295 177.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -80.58 -38.53 29.29 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.69 1.196 . . . . 0.0 113.151 -169.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -138.6 14.73 2.73 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.27 1.028 . . . . 0.0 113.084 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.668 1.987 . . . . 0.0 113.181 -174.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -90.05 119.61 30.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.069 0.948 . . . . 0.0 110.457 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -87.67 118.32 27.08 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.634 1.574 . . . . 0.0 111.631 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -117.67 136.64 53.19 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.442 1.897 . . . . 0.0 112.012 172.047 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 164' ' ' ILE . . . . . 0.409 HG12 ' H ' ' A' ' 164' ' ' ILE . 0.4 OUTLIER -54.32 127.37 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.314 1.446 . . . . 0.0 111.084 174.02 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -66.41 89.6 0.14 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.092 1.357 . . . . 0.0 112.523 -176.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 128.041 2.536 . . . . 0.0 112.565 176.797 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 . . . . . 0 N--CA 1.482 1.129 0 CA-C-O 119.506 -0.283 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.38 -42.88 96.77 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.899 0.88 . . . . 0.0 110.952 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -51.23 64.48 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.634 0.774 . . . . 0.0 111.961 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.57 -41.11 93.94 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.408 0.683 . . . . 0.0 112.404 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.508 HG13 HD11 ' A' ' 132' ' ' LEU . 53.7 mt -58.8 -51.91 66.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 124.679 1.192 . . . . 0.0 111.048 175.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.7 -50.62 71.74 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.16 0.584 . . . . 0.0 110.888 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -61.92 -41.82 98.37 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.909 1.684 . . . . 0.0 112.238 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -59.89 -54.45 46.08 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.434 1.094 . . . . 0.0 111.496 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.95 -19.23 63.38 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.647 -1.283 . . . . 0.0 113.178 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -73.56 -36.26 65.59 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.988 0.915 . . . . 0.0 111.361 169.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -83.24 -39.53 20.77 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.261 0.624 . . . . 0.0 112.34 -173.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.32 -28.92 13.08 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -167.19 23.8 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -172.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.4 ' HB3' HG22 ' A' ' 163' ' ' THR . 56.4 Cg_endo -64.29 126.71 17.56 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 124.091 3.194 . . . . 0.0 114.262 -169.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -140.58 163.01 34.0 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.437 1.495 . . . . 0.0 111.274 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -79.56 161.87 25.7 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.058 -1.651 . . . . 0.0 112.561 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.527 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.48 -33.46 63.7 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.47 0.708 . . . . 0.0 112.249 -179.025 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -64.99 -41.79 95.09 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.023 -0.423 . . . . 0.0 111.289 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 28.4 t -59.45 -45.27 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.16 0.584 . . . . 0.0 109.856 174.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.527 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -62.47 -43.79 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 123.952 0.901 . . . . 0.0 110.43 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.507 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.33 -53.72 54.94 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.615 1.166 . . . . 0.0 110.015 -177.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -63.52 -34.0 76.81 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.2 0.6 . . . . 0.0 112.071 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.96 -25.58 64.62 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.508 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -87.93 -11.91 46.2 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.781 1.632 . . . . 0.0 112.998 169.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.05 11.29 57.75 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.894 1.235 . . . . 0.0 114.26 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 31.5 mtt -81.47 176.88 9.32 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.441 1.896 . . . . 0.0 111.414 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -108.23 -31.91 7.7 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 68.4 p -134.85 155.02 51.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.551 1.14 . . . . 0.0 112.492 -169.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.02 -26.04 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.224 1.009 . . . . 0.0 113.667 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -68.4 -27.64 66.39 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.654 1.182 . . . . 0.0 113.679 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.28 -23.19 62.83 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.044 0.45 . . . . 0.0 111.431 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.507 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -102.05 -31.37 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.212 -0.93 . . . . 0.0 112.666 -177.589 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.62 -40.87 20.64 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.51 1.524 . . . . 0.0 112.539 -173.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -42.38 71.74 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 175.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -78.12 -42.08 33.04 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.83 0.852 . . . . 0.0 112.216 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.5 -52.39 65.41 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.84 0.856 . . . . 0.0 112.398 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -35.01 79.27 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.409 0.684 . . . . 0.0 110.973 179.04 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.2 mtp-105 -60.77 -45.44 94.32 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.411 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.58 -35.63 81.62 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.32 1.048 . . . . 0.0 111.548 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -64.31 -38.52 91.32 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.839 -1.163 . . . . 0.0 113.529 171.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.1 t -69.72 -17.9 63.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 174.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -113.83 15.3 18.67 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.84 38.52 0.93 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.561 1.544 . . . . 0.0 113.613 175.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.47 -32.04 3.92 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.946 1.698 . . . . 0.0 113.343 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -127.35 163.94 22.89 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 119.386 0.993 . . . . 0.0 113.275 175.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -148.34 115.33 6.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.167 2.187 . . . . 0.0 108.988 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.8 ttp -87.97 143.97 26.81 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.493 -0.754 . . . . 0.0 111.679 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.91 124.77 45.58 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 125.15 1.38 . . . . 0.0 110.265 175.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.69 -5.79 40.0 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.21 -0.931 . . . . 0.0 113.03 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -83.51 -33.65 25.49 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.729 1.212 . . . . 0.0 112.731 -176.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.3 t -143.96 10.75 1.56 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.879 1.272 . . . . 0.0 113.336 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.3 mmmt 52.81 36.75 22.2 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.388 2.275 . . . . 0.0 113.439 -169.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.94 119.35 27.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.614 0.766 . . . . 0.0 110.101 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.98 122.53 27.9 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 124.72 1.208 . . . . 0.0 110.857 172.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.4 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.6 OUTLIER -126.14 130.61 51.37 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.145 1.778 . . . . 0.0 108.673 -178.077 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.37 127.81 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 120.747 -1.221 . . . . 0.0 110.506 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -67.99 89.17 0.29 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.922 1.289 . . . . 0.0 111.886 -177.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? . . . . . 0 C--O 1.251 1.174 0 C-N-CA 127.358 2.263 . . . . 0.0 111.297 -179.226 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 . . . . . 0 N--CA 1.475 0.8 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -55.92 -47.92 76.64 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.833 0.742 . . . . 0.0 111.728 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -58.13 -50.56 73.06 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.434 0.693 . . . . 0.0 112.467 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -42.72 99.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.318 176.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.493 HG13 HD11 ' A' ' 132' ' ' LEU . 48.9 mt -56.41 -51.49 63.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 111.148 177.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.7 t80 -65.13 -50.44 66.0 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.593 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -55.51 -49.1 73.48 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.73 1.212 . . . . 0.0 112.157 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -56.18 -53.91 51.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.03 0.932 . . . . 0.0 111.455 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.4 mt -70.77 -19.63 62.69 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 120.802 -1.187 . . . . 0.0 112.944 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.59 -37.4 68.16 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.915 0.78 . . . . 0.0 110.895 169.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -81.22 -39.52 25.25 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.16 -28.22 13.13 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.13 -167.84 25.41 Favored Glycine 0 N--CA 1.471 0.97 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 -171.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -64.55 128.38 21.08 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.761 2.974 . . . . 0.0 114.103 -169.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.9 mm-40 -140.29 162.79 34.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.366 1.466 . . . . 0.0 110.662 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -81.32 161.4 23.87 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 120.159 -1.588 . . . . 0.0 112.008 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.532 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.02 -31.93 63.54 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.052 0.541 . . . . 0.0 112.326 -177.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.2 tp -65.16 -42.0 94.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.948 -0.47 . . . . 0.0 111.219 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.6 t -59.0 -44.99 92.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.055 0.542 . . . . 0.0 109.803 173.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.532 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -63.88 -43.6 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.745 0.818 . . . . 0.0 110.78 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.405 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.08 -54.22 45.93 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.131 1.372 . . . . 0.0 110.153 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -64.17 -34.21 77.56 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.972 0.509 . . . . 0.0 111.964 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.99 -25.92 64.76 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.493 HD11 HG13 ' A' ' 113' ' ' ILE . 2.8 mt -86.68 -11.96 49.75 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.684 1.594 . . . . 0.0 113.134 169.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.37 11.67 60.72 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.708 1.147 . . . . 0.0 113.901 -178.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.0 mmt -85.64 175.69 8.61 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.448 1.899 . . . . 0.0 111.004 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -107.94 -36.58 6.32 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -173.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.7 p -127.12 155.7 42.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.598 1.159 . . . . 0.0 112.403 -171.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.28 -24.64 66.54 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.508 1.123 . . . . 0.0 113.265 175.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -67.4 -28.16 67.68 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.02 1.328 . . . . 0.0 113.402 174.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -71.74 -15.42 62.19 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.268 0.627 . . . . 0.0 112.479 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.413 HG12 HD11 ' A' ' 113' ' ' ILE . 0.1 OUTLIER -113.59 -31.09 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.427 1.091 . . . . 0.0 113.062 -179.731 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.32 -41.99 40.19 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.878 1.271 . . . . 0.0 112.213 -175.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 -55.33 -37.72 67.79 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.44 1.096 . . . . 0.0 113.215 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -81.16 -45.51 16.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.289 1.036 . . . . 0.0 111.558 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.5 mt -58.57 -52.51 65.37 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.327 -178.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.57 -34.48 77.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.036 0.934 . . . . 0.0 111.033 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.7 mtp-105 -64.28 -45.02 89.83 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.279 174.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.96 -35.36 79.9 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.14 0.976 . . . . 0.0 110.801 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -63.4 -40.17 96.5 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.8 -1.188 . . . . 0.0 112.996 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 43.2 m -73.96 -13.82 60.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.568 1.147 . . . . 0.0 114.032 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -113.85 15.42 18.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.753 1.621 . . . . 0.0 115.04 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 72.43 39.05 0.76 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.584 1.554 . . . . 0.0 114.178 175.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -122.82 -31.87 3.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.184 1.794 . . . . 0.0 113.371 -177.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.418 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -128.87 166.24 19.47 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.575 1.08 . . . . 0.0 113.732 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -149.17 119.43 7.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.322 1.849 . . . . 0.0 109.556 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.7 ttp -86.75 144.27 27.15 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.208 -0.932 . . . . 0.0 111.922 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -86.94 130.98 34.23 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.943 1.297 . . . . 0.0 109.813 171.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.06 -10.4 59.73 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 124.637 1.175 . . . . 0.0 112.957 173.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -87.99 -38.53 15.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.409 0.684 . . . . 0.0 112.758 -171.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.6 t -143.74 18.9 1.83 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.176 0.99 . . . . 0.0 113.656 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.78 39.3 28.5 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.303 1.841 . . . . 0.0 113.512 -175.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.6 118.3 25.02 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.935 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -82.92 124.32 30.24 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 110.725 175.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.74 133.13 50.94 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.792 1.637 . . . . 0.0 108.869 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.33 131.61 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.564 1.146 . . . . 0.0 110.743 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -67.87 98.01 0.7 Allowed 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.946 0.879 . . . . 0.0 111.212 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 . . . . . 0 C--O 1.254 1.294 0 C-N-CA 127.215 2.206 . . . . 0.0 112.108 -176.819 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.567 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.06 -48.16 70.88 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.138 0.881 . . . . 0.0 111.915 174.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -55.26 -52.1 64.5 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.313 1.045 . . . . 0.0 112.588 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -38.44 85.24 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.377 179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.47 HG13 HD11 ' A' ' 132' ' ' LEU . 44.3 mt -57.33 -50.42 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 119.287 0.949 . . . . 0.0 110.873 178.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -63.84 -51.36 65.02 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.329 0.652 . . . . 0.0 110.694 -178.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -57.95 -43.96 86.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.09 1.356 . . . . 0.0 112.921 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -59.66 -53.69 55.1 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.297 1.039 . . . . 0.0 111.422 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.68 -18.96 62.82 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.827 -1.171 . . . . 0.0 113.04 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -73.48 -36.36 65.8 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.696 0.799 . . . . 0.0 110.891 169.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.64 -38.55 23.37 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.28 0.632 . . . . 0.0 112.378 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.17 -27.7 13.08 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 95.81 -167.7 25.76 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.432 ' HB3' HG22 ' A' ' 163' ' ' THR . 49.7 Cg_endo -63.76 127.76 20.43 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 124.05 3.167 . . . . 0.0 114.228 -169.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -141.3 162.36 35.68 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.401 1.48 . . . . 0.0 111.281 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 -80.57 161.38 24.8 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 120.159 -1.588 . . . . 0.0 112.298 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.539 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.82 -32.33 63.47 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.19 0.596 . . . . 0.0 112.428 -177.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.3 tp -66.38 -39.98 89.42 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.832 -0.543 . . . . 0.0 111.347 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 32.4 t -59.88 -45.7 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 122.927 0.491 . . . . 0.0 109.676 173.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.539 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -63.16 -43.38 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.93 0.892 . . . . 0.0 110.688 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.58 -55.11 35.85 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.203 1.401 . . . . 0.0 110.15 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -64.67 -33.95 77.14 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.939 0.496 . . . . 0.0 111.925 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.85 -26.79 65.33 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 177.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.47 HD11 HG13 ' A' ' 113' ' ' ILE . 3.5 mt -85.96 -12.01 51.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.036 169.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.92 10.6 59.78 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.803 1.192 . . . . 0.0 113.937 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.3 mmt -83.44 176.81 8.8 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.402 1.881 . . . . 0.0 111.109 175.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 88.3 mmt-85 -108.14 -31.06 8.07 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -174.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 66.5 p -135.58 156.56 48.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.337 1.055 . . . . 0.0 112.335 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.17 -25.18 66.84 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.646 1.178 . . . . 0.0 113.371 176.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.04 -27.48 66.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.267 1.427 . . . . 0.0 113.476 174.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.89 -15.33 62.11 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.384 0.673 . . . . 0.0 112.258 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.446 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -114.54 -31.56 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 124.398 1.079 . . . . 0.0 113.061 -179.418 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -48.29 -40.72 25.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.056 1.343 . . . . 0.0 112.729 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -55.82 -44.38 77.86 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.727 1.211 . . . . 0.0 112.683 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.22 -43.02 58.79 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.653 1.181 . . . . 0.0 111.849 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.97 -52.43 65.03 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.124 0.97 . . . . 0.0 112.131 -176.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.11 79.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.304 0.641 . . . . 0.0 110.768 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 -64.3 -42.06 96.54 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 118.523 -0.751 . . . . 0.0 110.857 176.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.33 -34.91 79.22 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.187 0.995 . . . . 0.0 111.411 175.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -64.98 -38.26 90.39 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.791 -1.193 . . . . 0.0 113.232 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.58 -17.49 63.55 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -113.73 15.2 18.8 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.49 38.68 0.98 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.6 1.56 . . . . 0.0 113.824 175.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.8 mp -120.63 -32.67 3.99 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.008 1.723 . . . . 0.0 112.959 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.447 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -129.11 164.29 23.63 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 177.038 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -149.3 115.38 5.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.274 1.83 . . . . 0.0 109.603 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.3 ttp -84.0 145.15 28.67 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 111.802 174.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -91.11 130.36 37.01 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.049 1.339 . . . . 0.0 109.815 171.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.66 -9.22 58.44 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 124.084 0.954 . . . . 0.0 113.05 173.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -87.45 -36.67 17.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.564 0.746 . . . . 0.0 112.865 -172.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.1 t -143.62 18.01 1.84 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.222 1.009 . . . . 0.0 113.551 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 52.39 40.0 28.58 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 126.813 2.045 . . . . 0.0 113.826 -175.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.74 119.74 27.29 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.426 0.691 . . . . 0.0 109.79 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -82.96 125.15 31.07 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.773 1.229 . . . . 0.0 110.953 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.432 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.2 p -130.58 128.29 40.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.234 1.414 . . . . 0.0 108.594 -173.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.62 129.16 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 120.597 -1.315 . . . . 0.0 110.947 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.33 89.25 0.33 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.689 1.195 . . . . 0.0 112.216 -177.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 C--O 1.253 1.239 0 C-N-CA 127.204 2.202 . . . . 0.0 112.012 178.018 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 . . . . . 0 N--CA 1.478 0.948 0 CA-C-O 119.439 -0.315 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.52 -44.8 89.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.91 0.884 . . . . 0.0 110.058 173.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.16 -55.17 31.33 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.835 0.854 . . . . 0.0 113.081 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -40.53 93.11 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 118.769 0.713 . . . . 0.0 112.324 -177.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.485 HD11 HG12 ' A' ' 140' ' ' VAL . 55.5 mt -61.91 -51.87 67.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 119.426 1.012 . . . . 0.0 111.381 178.411 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -64.02 -48.41 76.47 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.419 0.288 . . . . 0.0 110.782 -177.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -55.57 -50.53 69.82 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.1 1.36 . . . . 0.0 112.382 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.87 -52.04 65.46 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.922 0.889 . . . . 0.0 111.568 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.28 -19.79 63.08 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.92 -1.112 . . . . 0.0 112.931 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -73.3 -37.02 66.36 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.904 0.774 . . . . 0.0 111.185 169.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -80.73 -38.39 28.83 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 -173.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.18 -27.99 12.91 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -168.87 24.85 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -172.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.412 ' HB3' HG22 ' A' ' 163' ' ' THR . 45.6 Cg_endo -62.06 128.35 23.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.033 3.155 . . . . 0.0 113.888 -171.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.5 mm-40 -141.34 163.94 31.58 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.222 1.409 . . . . 0.0 111.189 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 52.2 mtt85 -81.63 159.98 23.87 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 120.322 -1.486 . . . . 0.0 111.928 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.535 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.66 -32.45 63.23 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.221 0.608 . . . . 0.0 112.535 -177.655 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.18 -42.05 94.01 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.792 0.437 . . . . 0.0 111.38 177.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.02 -44.73 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.226 0.61 . . . . 0.0 109.647 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.535 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.432 0.693 . . . . 0.0 110.853 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.478 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.3 -53.97 49.48 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.052 1.341 . . . . 0.0 110.047 -178.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -63.95 -34.07 77.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.223 0.609 . . . . 0.0 112.022 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.82 -24.58 64.4 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.478 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -89.99 -11.94 40.12 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.386 1.474 . . . . 0.0 113.168 169.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.04 10.46 61.16 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 125.007 1.289 . . . . 0.0 113.942 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.5 mmt -82.78 173.57 11.75 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.906 1.682 . . . . 0.0 110.684 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -108.03 -30.65 8.33 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -169.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 67.7 p -135.97 155.98 49.45 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.633 1.173 . . . . 0.0 112.012 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.85 -27.65 65.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.31 -25.56 64.29 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.898 1.279 . . . . 0.0 113.721 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.22 -27.48 66.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.272 0.558 . . . . 0.0 111.113 176.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.485 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.52 -31.18 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 123.62 0.768 . . . . 0.0 112.457 -172.969 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.37 -41.0 12.89 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 112.401 -175.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -54.2 -44.32 71.51 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.732 1.213 . . . . 0.0 113.261 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.27 -42.64 44.88 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.999 0.92 . . . . 0.0 111.568 175.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.17 -52.84 63.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.923 . . . . 0.0 112.255 -177.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -34.03 77.44 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.783 0.833 . . . . 0.0 111.081 176.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.1 mtp85 -58.98 -46.99 86.75 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.39 173.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 41.1 mtm -64.28 -34.65 78.6 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.427 0.691 . . . . 0.0 112.274 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -65.01 -34.34 78.21 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.1 t -75.29 -16.27 60.44 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 173.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -114.04 15.23 18.42 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 6.0 t60 71.54 40.0 0.85 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.494 1.518 . . . . 0.0 114.068 175.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.85 -33.13 3.41 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.249 1.82 . . . . 0.0 113.304 -177.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.7 mt -129.51 163.95 24.81 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.737 1.153 . . . . 0.0 113.575 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -149.06 117.02 6.31 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.208 1.803 . . . . 0.0 109.772 176.097 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.0 ttp -85.38 143.66 28.49 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.106 0.562 . . . . 0.0 112.088 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.23 123.59 42.39 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 125.909 1.684 . . . . 0.0 109.688 172.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.25 -5.5 36.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.736 0.814 . . . . 0.0 112.876 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -75.84 -36.25 59.7 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.189 1.395 . . . . 0.0 112.355 -178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -148.2 16.45 1.06 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mptt 52.69 40.9 31.13 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.501 1.92 . . . . 0.0 113.004 -170.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -81.88 118.79 23.2 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.663 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -84.22 124.78 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.929 1.291 . . . . 0.0 110.819 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.412 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.5 p -130.47 127.99 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.173 1.389 . . . . 0.0 108.385 -172.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.47 130.48 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 120.606 -1.309 . . . . 0.0 111.077 -179.146 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.84 96.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 122.221 1.01 . . . . 0.0 111.793 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.806 2.443 . . . . 0.0 110.937 -176.362 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -60.84 -45.73 93.32 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.22 0.918 . . . . 0.0 111.108 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.39 -49.5 77.04 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -43.86 95.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.727 0.811 . . . . 0.0 112.381 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.475 HD11 HG12 ' A' ' 140' ' ' VAL . 34.5 mt -58.59 -50.84 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.65 1.18 . . . . 0.0 111.508 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -62.64 -51.49 67.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.945 0.498 . . . . 0.0 111.076 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -61.22 -39.78 91.53 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.436 1.094 . . . . 0.0 112.344 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.48 -54.24 47.91 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.472 1.109 . . . . 0.0 111.482 173.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.46 -18.87 63.76 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.737 -1.227 . . . . 0.0 112.989 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -73.79 -37.15 65.04 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.896 0.878 . . . . 0.0 111.454 169.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.67 -38.89 25.18 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.323 0.649 . . . . 0.0 112.278 -173.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.09 -29.16 11.92 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.76 -167.82 23.37 Favored Glycine 0 N--CA 1.469 0.857 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -172.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.455 ' HB3' HG22 ' A' ' 163' ' ' THR . 56.2 Cg_endo -65.23 128.14 19.82 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.772 2.981 . . . . 0.0 113.814 -170.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -139.06 162.66 34.39 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.585 1.554 . . . . 0.0 111.19 -178.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -79.27 158.16 27.61 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.196 -1.565 . . . . 0.0 111.05 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.541 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.85 -31.72 59.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.262 0.625 . . . . 0.0 112.439 -179.024 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.6 tp -64.86 -41.32 95.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.165 0.586 . . . . 0.0 111.699 177.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.24 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.565 0.746 . . . . 0.0 109.121 174.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.541 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.52 -43.63 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.529 0.732 . . . . 0.0 110.453 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.458 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.19 -55.58 31.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.234 1.414 . . . . 0.0 109.875 -178.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -63.85 -34.63 78.37 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.289 0.636 . . . . 0.0 111.986 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.24 64.28 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.451 HD11 HG13 ' A' ' 113' ' ' ILE . 4.2 mt -89.96 -11.96 40.16 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.488 1.515 . . . . 0.0 113.236 170.574 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 95.64 5.88 59.87 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.288 1.423 . . . . 0.0 114.248 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 20.4 mmm -80.93 173.77 12.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.557 1.543 . . . . 0.0 110.902 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -106.77 -29.91 9.25 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -170.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.9 p -137.77 156.37 48.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.412 1.085 . . . . 0.0 112.206 -171.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.94 -28.66 64.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.345 1.058 . . . . 0.0 113.833 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.74 -25.1 63.67 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.866 1.266 . . . . 0.0 113.705 176.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.23 -28.5 67.29 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.219 0.533 . . . . 0.0 110.915 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.475 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.01 -31.47 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.531 0.732 . . . . 0.0 112.334 -172.663 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.29 -41.64 6.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.029 1.732 . . . . 0.0 112.872 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -44.84 75.73 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.621 1.168 . . . . 0.0 112.769 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -77.19 -38.7 51.0 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.033 0.933 . . . . 0.0 112.625 175.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.19 -51.4 67.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.768 0.827 . . . . 0.0 112.215 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -33.12 75.29 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.969 -0.457 . . . . 0.0 111.005 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -64.47 -41.22 96.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.355 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.3 mtp -63.86 -37.23 86.64 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.258 0.936 . . . . 0.0 111.997 172.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 120.452 -1.405 . . . . 0.0 112.321 173.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.6 t -67.04 -14.32 62.78 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.231 1.412 . . . . 0.0 114.111 175.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 -113.25 13.23 19.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.547 1.139 . . . . 0.0 114.009 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.6 t60 69.01 39.37 1.79 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.122 1.369 . . . . 0.0 113.087 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -121.71 -34.2 3.45 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.196 1.398 . . . . 0.0 113.478 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.5 mp -119.63 160.35 22.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.799 1.24 . . . . 0.0 112.673 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -144.38 115.38 7.86 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.966 1.706 . . . . 0.0 109.87 174.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.4 ttp -85.83 144.12 27.89 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.298 0.57 . . . . 0.0 111.979 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.15 119.93 40.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.862 1.665 . . . . 0.0 107.999 173.287 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.97 -12.47 60.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.906 0.882 . . . . 0.0 113.286 -172.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -77.52 -35.0 53.84 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.428 1.491 . . . . 0.0 112.68 -170.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.8 t -135.09 11.79 3.58 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.701 1.2 . . . . 0.0 112.797 171.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm 53.44 38.94 29.17 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.128 1.771 . . . . 0.0 112.232 -169.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.82 116.05 19.76 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.344 0.658 . . . . 0.0 109.438 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -81.08 125.37 30.12 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.628 1.171 . . . . 0.0 110.533 171.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.455 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.8 OUTLIER -120.04 163.6 17.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 107.621 176.492 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.94 130.03 36.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 120.817 -1.177 . . . . 0.0 109.467 172.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -68.03 89.62 0.3 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.927 1.291 . . . . 0.0 111.539 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.4 ptt180 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 127.075 2.15 . . . . 0.0 113.004 178.254 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 . . . . . 0 N--CA 1.479 1.011 0 CA-C-O 119.567 -0.254 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -61.32 -43.14 99.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 122.943 0.497 . . . . 0.0 110.809 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.44 -48.79 80.3 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 122.003 -0.436 . . . . 0.0 112.091 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.565 0.746 . . . . 0.0 112.271 178.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.526 HD11 HG12 ' A' ' 140' ' ' VAL . 25.1 mt -55.89 -51.27 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.985 1.314 . . . . 0.0 111.332 177.186 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.415 ' CD2' HD12 ' A' ' 152' ' ' LEU . 37.0 t80 -63.49 -51.45 65.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.716 0.406 . . . . 0.0 111.025 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -56.49 -41.63 76.93 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.983 1.313 . . . . 0.0 112.67 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -62.75 -53.26 57.02 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.844 1.258 . . . . 0.0 111.49 175.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.71 -18.71 63.56 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.884 -1.135 . . . . 0.0 112.681 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -73.7 -37.12 65.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 118.938 0.79 . . . . 0.0 111.474 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.96 -38.71 27.24 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.384 0.674 . . . . 0.0 112.319 -173.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -28.69 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.76 -169.23 25.52 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.95 130.24 26.97 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.497 2.798 . . . . 0.0 114.09 -170.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -139.07 163.56 32.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.604 1.562 . . . . 0.0 110.832 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -78.61 157.67 28.65 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 120.21 -1.556 . . . . 0.0 111.106 177.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.504 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -53.26 -33.92 55.09 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.759 0.824 . . . . 0.0 112.524 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.07 -41.26 95.27 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.331 0.652 . . . . 0.0 111.879 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.6 t -59.61 -46.05 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.504 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -60.74 -43.18 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.347 0.659 . . . . 0.0 110.328 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.54 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.5 -54.21 49.44 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.024 -177.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.86 -33.51 76.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.313 0.645 . . . . 0.0 112.119 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.18 -25.13 64.19 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 123.673 0.789 . . . . 0.0 112.962 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.427 HD11 HG13 ' A' ' 113' ' ' ILE . 2.9 mt -89.95 -11.86 40.48 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.678 1.591 . . . . 0.0 113.334 170.221 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.48 11.48 59.45 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.689 1.138 . . . . 0.0 114.381 -178.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' MET . . . . . 0.425 ' HE3' HD13 ' A' ' 132' ' ' LEU . 33.3 mtt -80.32 176.86 9.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.218 1.807 . . . . 0.0 111.116 171.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 86.0 mtt85 -107.69 -36.8 6.32 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -175.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -132.41 157.01 45.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.459 1.104 . . . . 0.0 112.506 -170.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.45 -27.51 66.14 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.78 1.029 . . . . 0.0 113.78 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -70.58 -23.5 62.6 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.644 1.578 . . . . 0.0 113.986 175.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -71.39 -25.17 62.24 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.276 0.489 . . . . 0.0 111.078 174.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.54 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -102.16 -31.45 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.404 0.682 . . . . 0.0 112.634 -175.723 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.38 -38.58 13.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.553 1.541 . . . . 0.0 113.325 -173.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -47.6 76.86 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.668 1.587 . . . . 0.0 112.441 174.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' ASP . . . . . 0.436 ' HB3' HD12 ' A' ' 113' ' ' ILE . 9.2 m-20 -72.72 -41.1 65.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.863 1.265 . . . . 0.0 111.904 176.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.42 -52.14 62.81 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.676 0.79 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.63 -33.67 76.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.844 0.458 . . . . 0.0 110.676 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -67.58 -39.29 84.87 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.03 177.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.74 -37.26 85.89 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 119.704 1.138 . . . . 0.0 111.924 171.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -64.79 -41.17 96.04 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.645 -1.284 . . . . 0.0 112.194 173.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -66.62 -13.99 61.85 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.994 1.318 . . . . 0.0 114.182 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -113.17 13.0 19.18 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.821 1.248 . . . . 0.0 113.972 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.5 t60 69.49 39.32 1.61 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.225 1.41 . . . . 0.0 113.324 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.415 HD12 ' CD2' ' A' ' 114' ' ' TYR . 4.5 mm? -121.47 -34.27 3.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.333 1.453 . . . . 0.0 113.153 -178.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.3 mp -119.9 160.76 22.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.931 1.293 . . . . 0.0 113.11 175.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -142.66 115.55 8.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.348 1.859 . . . . 0.0 110.185 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.2 ttp -88.27 143.66 26.9 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.087 -1.008 . . . . 0.0 112.25 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -89.39 130.81 35.7 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.849 1.26 . . . . 0.0 108.342 169.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.52 -14.11 61.16 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 121.09 -1.006 . . . . 0.0 112.536 175.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -85.35 -37.65 19.66 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -169.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -137.17 13.43 3.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.437 1.095 . . . . 0.0 113.148 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 52.52 42.14 31.25 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.221 1.809 . . . . 0.0 113.035 -176.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.13 117.61 25.98 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.903 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -83.98 120.0 25.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.633 1.173 . . . . 0.0 110.639 173.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.22 165.5 11.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.811 2.044 . . . . 0.0 108.786 170.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.24 127.65 39.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.471 1.108 . . . . 0.0 109.637 170.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -66.15 88.65 0.12 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.392 1.477 . . . . 0.0 112.027 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 45.8 ttm105 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 127.023 2.129 . . . . 0.0 112.037 178.877 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.96 -43.8 86.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.064 1.346 . . . . 0.0 111.045 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -64.92 -50.92 64.59 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.723 0.809 . . . . 0.0 112.385 176.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.45 -40.21 96.52 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.241 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.547 HG13 HD11 ' A' ' 132' ' ' LEU . 51.3 mt -57.91 -51.0 76.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 119.502 1.047 . . . . 0.0 110.992 176.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -63.54 -50.81 68.09 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.758 0.423 . . . . 0.0 110.663 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -58.96 -42.07 88.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.662 1.185 . . . . 0.0 112.963 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.47 -53.56 54.89 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.813 1.245 . . . . 0.0 111.685 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.91 -19.68 64.21 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.987 -1.071 . . . . 0.0 112.618 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -72.99 -37.21 67.08 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.899 0.88 . . . . 0.0 110.892 169.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -76.53 -41.26 47.36 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.947 0.499 . . . . 0.0 112.029 -174.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.12 -28.14 11.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -178.567 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.36 -168.48 25.53 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 -172.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -62.71 128.58 23.72 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.615 2.877 . . . . 0.0 114.155 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.0 mm-40 -138.96 164.21 30.32 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.132 1.373 . . . . 0.0 110.673 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 63.8 mtt85 -80.56 160.22 25.23 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.36 -1.462 . . . . 0.0 111.347 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.53 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.43 -33.07 63.24 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.278 0.631 . . . . 0.0 112.413 -177.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.3 tp -65.56 -39.79 92.07 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.255 0.622 . . . . 0.0 111.636 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.71 -46.3 96.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 174.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.53 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -61.35 -43.06 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.26 0.624 . . . . 0.0 110.488 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.517 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.9 -54.31 48.4 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.662 1.185 . . . . 0.0 110.145 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.78 -33.63 76.44 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.209 0.604 . . . . 0.0 112.131 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.87 65.37 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.396 0.678 . . . . 0.0 112.789 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.547 HD11 HG13 ' A' ' 113' ' ' ILE . 3.1 mt -88.47 -11.89 44.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.746 1.619 . . . . 0.0 113.394 169.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 11.66 60.18 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 124.704 1.145 . . . . 0.0 114.206 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.0 mtt -79.6 176.95 9.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.23 1.812 . . . . 0.0 111.21 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.99 -35.43 6.62 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 70.2 p -133.13 155.73 48.75 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.699 1.2 . . . . 0.0 112.37 -170.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.3 -27.33 65.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.162 0.985 . . . . 0.0 113.655 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.35 -26.92 65.84 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -68.79 -25.97 64.97 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.044 0.45 . . . . 0.0 111.241 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.517 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -100.68 -31.11 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 121.241 -0.912 . . . . 0.0 112.509 -176.0 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.67 -41.59 22.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.848 1.659 . . . . 0.0 112.216 -174.035 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -54.67 -41.15 69.82 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.567 1.147 . . . . 0.0 113.12 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -78.68 -44.45 23.62 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.559 0.744 . . . . 0.0 111.708 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.28 -52.45 65.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.274 1.029 . . . . 0.0 112.581 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.81 81.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.758 0.823 . . . . 0.0 111.036 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -62.85 -42.01 99.58 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.796 175.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 87.5 mtp -65.77 -34.39 78.07 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.111 0.964 . . . . 0.0 111.091 176.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.9 tttp -65.12 -37.41 87.34 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.998 -1.064 . . . . 0.0 113.399 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -70.05 -18.04 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 174.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -113.75 15.85 18.64 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.44 38.6 1.0 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.487 1.515 . . . . 0.0 113.947 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.39 -32.4 3.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.966 1.707 . . . . 0.0 113.281 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.4 mt -129.08 164.51 23.13 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.491 1.041 . . . . 0.0 113.541 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -147.95 118.55 7.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.711 2.004 . . . . 0.0 109.398 175.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.6 ttp -88.35 143.15 27.19 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.132 -0.98 . . . . 0.0 112.083 173.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -87.22 129.69 34.87 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.95 1.3 . . . . 0.0 109.312 170.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -71.1 -13.0 61.81 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 124.029 0.932 . . . . 0.0 112.432 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 63.6 mm-40 -83.69 -42.6 16.45 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.121 0.968 . . . . 0.0 112.729 -171.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 21.5 t -136.82 15.48 3.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.545 1.138 . . . . 0.0 113.499 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? 52.26 40.99 30.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.553 1.541 . . . . 0.0 112.801 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.15 118.0 24.45 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.637 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -85.03 121.94 28.53 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.713 1.205 . . . . 0.0 111.149 177.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.2 133.34 54.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.994 1.718 . . . . 0.0 109.559 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.81 127.49 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 O-C-N 120.454 -1.404 . . . . 0.0 110.632 176.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.8 92.46 0.22 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.694 1.198 . . . . 0.0 111.937 -177.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.268 1.827 . . . . 0.0 113.826 178.275 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 24.5 mtm180 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.88 -45.1 95.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.544 1.065 . . . . 0.0 111.062 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.36 -47.54 85.64 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.537 0.735 . . . . 0.0 111.469 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.5 -40.7 97.76 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.826 0.85 . . . . 0.0 113.254 177.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.499 HD11 HG12 ' A' ' 140' ' ' VAL . 30.2 mt -60.87 -50.24 81.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 124.359 1.063 . . . . 0.0 111.591 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -61.33 -51.35 69.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.662 0.267 . . . . 0.0 110.79 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -58.98 -42.08 89.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.19 1.396 . . . . 0.0 113.23 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -60.63 -53.68 54.54 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.28 1.032 . . . . 0.0 111.329 174.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.43 -19.6 62.97 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.768 -1.208 . . . . 0.0 112.877 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.95 -38.07 69.85 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.554 1.142 . . . . 0.0 111.043 169.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -82.16 -39.55 23.07 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.322 0.649 . . . . 0.0 112.295 -172.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.94 -28.94 12.1 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.75 -168.19 23.6 Favored Glycine 0 N--CA 1.47 0.946 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -171.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.33 129.12 20.75 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.562 2.841 . . . . 0.0 114.063 -169.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -140.61 161.03 38.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.774 1.629 . . . . 0.0 110.967 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -78.15 161.18 27.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 119.786 -1.822 . . . . 0.0 112.428 176.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.547 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.83 -31.67 62.91 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.259 0.624 . . . . 0.0 112.423 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -41.15 92.48 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.876 -0.515 . . . . 0.0 111.478 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.7 t -59.46 -46.59 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.003 0.521 . . . . 0.0 109.679 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.547 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -61.82 -43.43 97.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.087 0.955 . . . . 0.0 110.232 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.479 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.91 -54.63 44.35 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.904 1.282 . . . . 0.0 110.061 -177.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -64.45 -34.78 79.0 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.161 0.585 . . . . 0.0 112.02 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.29 -25.47 64.26 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.425 HD11 HG13 ' A' ' 113' ' ' ILE . 5.2 mt -89.98 -12.12 39.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.554 1.542 . . . . 0.0 113.36 171.195 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 9.95 62.08 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.757 1.17 . . . . 0.0 114.475 -177.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 18.0 mmt -80.63 176.64 9.62 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.34 1.456 . . . . 0.0 110.632 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -108.09 -31.64 7.86 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -172.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 58.1 p -136.83 156.96 47.81 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.417 1.087 . . . . 0.0 112.234 -171.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -29.89 65.26 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.337 1.055 . . . . 0.0 113.758 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -69.19 -25.12 64.17 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.849 1.26 . . . . 0.0 113.639 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.7 -27.55 66.05 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.193 0.451 . . . . 0.0 110.966 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.499 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.8 -31.14 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.503 0.721 . . . . 0.0 112.565 -173.378 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.65 -41.64 6.84 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.098 1.759 . . . . 0.0 112.591 -176.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -54.73 -44.94 74.0 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.74 1.216 . . . . 0.0 113.106 175.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.7 -41.72 52.87 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.96 0.904 . . . . 0.0 111.846 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.0 mt -60.84 -52.48 64.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.454 1.101 . . . . 0.0 112.493 -177.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -33.1 75.2 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.351 0.661 . . . . 0.0 110.981 178.363 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -64.45 -42.15 96.14 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.99 176.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.0 mtp -64.47 -35.94 82.58 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.182 0.901 . . . . 0.0 112.136 173.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.18 -41.79 94.28 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.465 -1.397 . . . . 0.0 112.605 173.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.4 t -63.75 -16.15 60.43 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.45 1.1 . . . . 0.0 113.632 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -113.55 15.28 19.01 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 70.83 37.14 1.38 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.393 1.477 . . . . 0.0 113.389 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -121.62 -33.48 3.6 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.124 1.37 . . . . 0.0 113.62 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.8 mp -118.73 161.76 19.58 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.623 1.169 . . . . 0.0 112.53 172.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -144.58 120.49 10.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.441 1.496 . . . . 0.0 110.374 172.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.9 ttp -87.84 144.44 26.59 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.193 -0.942 . . . . 0.0 112.111 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.71 126.17 41.69 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 125.414 1.486 . . . . 0.0 109.977 173.36 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -74.0 -4.11 33.33 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 124.702 1.201 . . . . 0.0 113.629 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.7 -33.91 15.6 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.552 1.141 . . . . 0.0 112.817 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.5 t -141.26 10.19 2.1 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.855 1.262 . . . . 0.0 113.225 -178.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 51.04 38.12 19.74 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 127.189 2.196 . . . . 0.0 113.584 -169.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.01 117.79 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.995 -176.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.56 121.53 26.43 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.391 1.076 . . . . 0.0 110.459 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.2 164.41 13.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.89 2.076 . . . . 0.0 108.754 171.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.61 126.92 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 124.154 0.982 . . . . 0.0 108.516 169.622 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -64.0 88.81 0.05 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.576 1.551 . . . . 0.0 112.02 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.269 0 C-N-CA 127.987 2.515 . . . . 0.0 113.203 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 118.39 -0.814 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -55.11 -46.67 75.59 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.099 0.863 . . . . 0.0 112.122 175.405 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -55.46 -51.92 65.35 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.344 1.058 . . . . 0.0 113.264 173.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -37.38 83.23 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.232 -0.917 . . . . 0.0 112.504 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.529 HD11 HG12 ' A' ' 140' ' ' VAL . 33.9 mt -56.86 -49.5 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.858 0.863 . . . . 0.0 110.59 178.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -62.83 -52.35 63.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.279 0.632 . . . . 0.0 110.658 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -57.74 -42.87 84.81 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.302 1.441 . . . . 0.0 113.184 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -60.11 -54.44 45.84 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.535 1.134 . . . . 0.0 111.375 173.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.7 mt -71.0 -19.18 62.55 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.668 -1.27 . . . . 0.0 113.079 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -72.55 -37.55 68.24 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.36 1.064 . . . . 0.0 110.803 169.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.21 -39.79 22.62 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.221 0.609 . . . . 0.0 112.312 -172.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.62 -29.15 12.84 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 177.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.25 -169.17 24.83 Favored Glycine 0 N--CA 1.47 0.91 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -171.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -64.24 128.97 22.84 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.007 3.138 . . . . 0.0 114.122 -170.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -140.63 163.41 32.95 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.535 1.534 . . . . 0.0 110.762 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -80.43 161.98 24.66 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.137 -1.602 . . . . 0.0 112.401 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.538 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.9 -32.11 63.46 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.481 0.712 . . . . 0.0 112.545 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.77 -41.72 91.71 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.96 -0.463 . . . . 0.0 111.412 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.47 -45.39 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 122.906 0.482 . . . . 0.0 109.882 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -62.44 -43.53 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.869 0.868 . . . . 0.0 110.468 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.52 -54.68 42.95 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.708 1.203 . . . . 0.0 109.989 -177.253 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.62 0.768 . . . . 0.0 111.971 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.86 -25.75 64.8 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.437 HD11 HG13 ' A' ' 113' ' ' ILE . 3.2 mt -89.45 -11.94 41.59 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.179 1.391 . . . . 0.0 113.192 170.091 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.9 6.73 63.28 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.226 1.393 . . . . 0.0 114.129 -177.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.7 mmt -77.76 172.54 13.27 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.281 1.432 . . . . 0.0 110.292 171.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -108.21 -30.33 8.43 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -135.1 156.75 48.49 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.742 1.217 . . . . 0.0 112.062 -174.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.43 -28.73 67.21 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -66.16 -29.38 69.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.894 1.278 . . . . 0.0 113.702 175.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.53 -26.78 67.31 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.641 0.257 . . . . 0.0 111.14 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.529 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.32 -31.11 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.598 0.759 . . . . 0.0 112.427 -175.72 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.18 -40.75 7.49 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.522 1.529 . . . . 0.0 113.066 -176.017 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -44.69 77.67 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.736 1.214 . . . . 0.0 113.021 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.49 -41.95 59.84 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.286 1.034 . . . . 0.0 111.828 175.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.44 -52.05 66.16 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.695 0.798 . . . . 0.0 112.463 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.75 -32.89 74.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.476 0.71 . . . . 0.0 111.241 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -70.28 -33.49 71.65 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.242 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 94.2 mtp -72.09 -34.29 68.54 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.598 1.159 . . . . 0.0 111.873 170.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 153' ' ' LEU . 25.4 tttp -63.05 -42.09 99.63 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 120.424 -1.423 . . . . 0.0 112.411 172.047 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.5 m -67.17 -14.67 63.13 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -114.13 13.77 18.11 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.84 1.793 . . . . 0.0 115.84 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.48 38.02 0.85 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.44 1.496 . . . . 0.0 113.269 178.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.2 mp -119.8 -32.09 4.34 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.086 1.354 . . . . 0.0 113.275 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.453 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.9 mt -126.94 164.44 21.47 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.128 0.971 . . . . 0.0 113.13 175.115 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -149.37 121.93 8.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.653 1.981 . . . . 0.0 109.197 174.093 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.5 ttp -90.22 144.73 25.59 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.191 -0.943 . . . . 0.0 112.063 173.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.12 126.01 42.0 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.126 1.37 . . . . 0.0 110.26 174.055 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.25 -6.52 43.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.114 0.966 . . . . 0.0 113.181 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -87.29 -34.78 18.78 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.441 1.096 . . . . 0.0 113.117 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.4 t -141.31 10.4 2.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.827 1.251 . . . . 0.0 113.176 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 51.37 38.87 22.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 127.061 2.145 . . . . 0.0 113.521 -169.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.83 119.1 26.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.374 0.67 . . . . 0.0 109.962 -175.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -83.51 119.96 25.34 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.518 1.127 . . . . 0.0 110.652 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.97 135.13 54.34 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.969 1.707 . . . . 0.0 108.915 175.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -55.38 130.04 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 120.57 -1.331 . . . . 0.0 109.622 169.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -67.37 86.8 0.18 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.959 1.303 . . . . 0.0 112.36 -177.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 60.8 ttp85 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.178 2.991 . . . . 0.0 113.552 -178.344 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.85 -44.81 96.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.068 0.947 . . . . 0.0 111.279 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.53 -46.58 82.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.654 0.781 . . . . 0.0 111.864 174.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.37 -44.95 92.66 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.649 0.78 . . . . 0.0 112.317 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.482 HD11 HG12 ' A' ' 140' ' ' VAL . 49.1 mt -58.65 -50.32 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.537 1.135 . . . . 0.0 111.12 178.091 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -64.77 -50.28 67.44 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.296 0.639 . . . . 0.0 110.821 -178.055 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -57.33 -45.95 83.77 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.727 1.211 . . . . 0.0 112.245 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -58.12 -53.99 52.02 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.093 0.957 . . . . 0.0 111.433 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.7 mt -70.48 -18.9 62.97 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.82 -1.175 . . . . 0.0 113.193 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -74.35 -36.12 63.59 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.557 0.743 . . . . 0.0 111.415 169.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -82.26 -38.67 24.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.528 0.731 . . . . 0.0 112.234 -173.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -28.62 12.7 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.42 -168.58 24.22 Favored Glycine 0 N--CA 1.469 0.898 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -172.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.444 ' HB3' HG22 ' A' ' 163' ' ' THR . 43.5 Cg_endo -62.49 127.88 22.05 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 124.066 3.177 . . . . 0.0 113.983 -171.129 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -141.28 163.12 33.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.205 1.402 . . . . 0.0 111.144 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 51.6 mtt85 -81.08 160.09 24.56 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.253 -1.529 . . . . 0.0 111.924 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.542 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.03 -31.82 63.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.138 0.575 . . . . 0.0 112.412 -177.669 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.9 tp -64.83 -41.93 95.35 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.946 -0.471 . . . . 0.0 111.401 176.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.68 -45.34 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.096 0.558 . . . . 0.0 109.679 174.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.542 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -62.64 -44.19 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 110.408 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.56 -54.76 40.01 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.105 1.362 . . . . 0.0 110.096 -177.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -64.0 -34.34 77.77 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.381 0.672 . . . . 0.0 112.102 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.17 -25.18 64.23 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 113' ' ' ILE . 2.8 mt -88.94 -12.0 42.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.378 1.471 . . . . 0.0 113.157 169.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.86 11.0 59.47 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.838 1.209 . . . . 0.0 114.119 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.1 mmt -83.43 176.3 9.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.964 1.706 . . . . 0.0 110.817 172.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -105.88 -38.81 6.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -171.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.7 p -130.45 156.37 44.87 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.459 1.103 . . . . 0.0 112.504 -169.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -28.2 63.82 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.42 1.088 . . . . 0.0 113.802 175.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -69.3 -25.37 64.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.889 1.276 . . . . 0.0 113.797 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.29 -27.95 66.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.12 0.486 . . . . 0.0 111.095 176.685 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.482 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.67 -31.25 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.539 0.736 . . . . 0.0 112.531 -173.109 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.2 -41.45 8.29 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.048 1.739 . . . . 0.0 112.485 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -54.39 -43.55 71.51 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.581 1.152 . . . . 0.0 113.34 175.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.34 -45.32 32.67 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.548 0.739 . . . . 0.0 111.384 175.266 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.37 -52.04 66.98 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.326 1.05 . . . . 0.0 112.662 -177.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -36.15 82.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.629 0.772 . . . . 0.0 110.779 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -68.09 -37.38 81.14 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.771 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.7 mtp -67.41 -34.65 77.69 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.944 0.898 . . . . 0.0 111.19 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -61.9 -46.04 91.11 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 113.136 171.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 59.9 m -63.74 -16.04 60.11 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 4.5 ptp85 -113.82 16.24 18.48 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 176.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.3 t60 71.42 37.92 1.09 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.863 1.265 . . . . 0.0 113.241 175.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -118.84 -33.4 4.23 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.767 1.627 . . . . 0.0 112.674 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mt -128.31 164.33 22.85 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -150.87 116.51 5.46 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.115 1.766 . . . . 0.0 109.771 176.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 47.2 ttp -85.79 144.57 27.67 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.713 -0.617 . . . . 0.0 111.943 174.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.05 125.83 38.91 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.514 1.526 . . . . 0.0 108.977 170.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.0 -8.15 54.41 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.005 -1.059 . . . . 0.0 112.885 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -84.44 -35.66 22.88 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.866 1.266 . . . . 0.0 112.835 -171.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -139.46 14.25 2.56 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.032 0.933 . . . . 0.0 112.955 172.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt 54.01 41.18 32.13 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 127.156 2.182 . . . . 0.0 113.134 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.17 119.79 25.95 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.558 0.743 . . . . 0.0 109.863 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -83.59 124.61 30.96 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.964 1.306 . . . . 0.0 110.69 173.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.4 p -129.34 127.34 40.88 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.379 1.471 . . . . 0.0 107.8 -174.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.0 130.3 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.58 -1.325 . . . . 0.0 110.451 178.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -67.74 86.83 0.22 Allowed 'General case' 0 CA--C 1.547 0.828 0 CA-C-O 122.657 1.218 . . . . 0.0 112.032 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 . . . . . 0 C--O 1.253 1.285 0 C-N-CA 128.139 2.576 . . . . 0.0 111.85 -175.176 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -58.62 -49.07 78.85 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.115 0.87 . . . . 0.0 111.01 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.56 -46.43 86.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.005 0.522 . . . . 0.0 112.058 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.4 -42.62 98.79 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.51 HG13 HD11 ' A' ' 132' ' ' LEU . 41.8 mt -58.27 -49.73 80.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 C-N-CA 124.612 1.165 . . . . 0.0 110.814 176.229 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -61.76 -51.66 67.42 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.013 0.925 . . . . 0.0 111.263 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.3 ttp85 -61.27 -42.47 98.7 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.53 1.532 . . . . 0.0 112.377 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.6 -52.11 66.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.701 0.8 . . . . 0.0 111.452 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.439 HD12 HD21 ' A' ' 153' ' ' LEU . 88.4 mt -71.3 -18.43 62.41 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.934 -1.104 . . . . 0.0 112.859 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.46 ' HA ' HD11 ' A' ' 164' ' ' ILE . 12.0 ttmt -69.96 -36.23 75.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.939 0.896 . . . . 0.0 110.386 169.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.28 -39.91 27.9 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -174.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -111.22 -21.04 12.1 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 86.85 -165.5 36.51 Favored Glycine 0 N--CA 1.476 1.34 0 CA-C-O 117.987 -1.451 . . . . 0.0 111.281 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -54.48 120.82 8.67 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.871 3.047 . . . . 0.0 114.531 -171.035 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -135.41 157.04 47.89 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.473 1.509 . . . . 0.0 110.175 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -76.63 162.21 27.92 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 119.932 -1.73 . . . . 0.0 111.867 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.541 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.84 -30.97 62.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.169 0.588 . . . . 0.0 112.139 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.15 -42.5 93.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.792 -0.568 . . . . 0.0 111.288 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 36.3 t -59.3 -45.7 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.059 0.544 . . . . 0.0 109.669 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.541 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -62.61 -44.14 99.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.859 0.864 . . . . 0.0 110.294 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.43 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -54.99 -54.58 41.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.291 1.436 . . . . 0.0 109.954 -178.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -64.53 -34.33 77.99 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.126 0.571 . . . . 0.0 112.036 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.83 -24.67 64.4 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.638 0.775 . . . . 0.0 113.041 177.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.51 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -90.04 -11.93 40.03 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.66 1.584 . . . . 0.0 113.533 169.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.82 10.82 61.08 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.736 1.16 . . . . 0.0 114.345 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.41 175.78 9.58 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.928 1.691 . . . . 0.0 110.76 172.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -107.74 -34.92 6.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -170.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.2 p -131.95 155.99 46.96 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.541 1.136 . . . . 0.0 112.308 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.04 -28.33 64.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.517 1.127 . . . . 0.0 113.688 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.33 -25.49 64.23 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.878 1.271 . . . . 0.0 113.734 176.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -68.27 -27.43 66.32 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.283 0.492 . . . . 0.0 110.941 177.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.472 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -102.42 -31.22 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 123.592 0.757 . . . . 0.0 112.655 -173.476 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.28 -41.64 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.636 1.575 . . . . 0.0 112.741 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -41.14 69.96 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.803 1.241 . . . . 0.0 113.423 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -79.77 -41.49 26.45 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.2 1.0 . . . . 0.0 112.147 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.07 -52.79 63.42 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.591 0.756 . . . . 0.0 112.226 -178.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -34.19 77.67 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.744 0.818 . . . . 0.0 111.204 178.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 16.1 mtp-105 -60.19 -46.41 89.81 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.636 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.4 ' HB2' HD12 ' A' ' 153' ' ' LEU . 33.9 mtp -66.95 -35.13 79.29 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.057 0.943 . . . . 0.0 111.793 178.134 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -65.33 -38.31 89.74 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.667 -1.27 . . . . 0.0 113.121 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.5 m -72.1 -14.55 61.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.213 1.005 . . . . 0.0 113.574 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -113.92 13.48 18.33 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 178.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 73.26 36.71 0.8 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.882 1.673 . . . . 0.0 114.148 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.7 mp -121.38 -32.08 3.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.069 1.348 . . . . 0.0 113.668 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.461 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.7 mt -124.34 164.01 20.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.453 1.101 . . . . 0.0 113.036 173.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -148.42 115.42 6.1 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.348 1.859 . . . . 0.0 108.82 179.369 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.5 ttp -87.67 141.41 28.63 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.379 -0.826 . . . . 0.0 111.587 172.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.84 126.68 37.02 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 124.713 1.205 . . . . 0.0 110.066 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -71.48 -7.12 45.42 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 124.273 1.029 . . . . 0.0 113.19 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -90.22 -33.88 16.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.595 1.158 . . . . 0.0 112.882 -173.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.2 t -142.0 11.26 1.99 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.99 1.316 . . . . 0.0 113.127 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 51.29 37.77 19.64 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 127.361 2.264 . . . . 0.0 114.106 -171.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -89.59 116.88 28.06 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.602 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -79.2 122.34 26.16 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.044 1.337 . . . . 0.0 111.294 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.4 t -132.18 144.43 50.66 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.809 1.643 . . . . 0.0 112.914 171.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' ILE . . . . . 0.46 HD11 ' HA ' ' A' ' 118' ' ' LYS . 0.4 OUTLIER -55.73 125.79 11.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 126.088 1.755 . . . . 0.0 111.29 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -65.1 89.42 0.08 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.503 1.521 . . . . 0.0 112.829 -177.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 77.0 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 128.301 2.64 . . . . 0.0 112.279 171.346 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.9 -42.99 90.88 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 110.882 177.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.11 -50.92 68.61 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.415 1.086 . . . . 0.0 112.552 175.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -38.34 90.24 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.619 -0.705 . . . . 0.0 112.525 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.507 HD11 HG12 ' A' ' 140' ' ' VAL . 44.1 mt -58.69 -50.75 78.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 119.248 0.931 . . . . 0.0 110.746 176.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.36 -51.65 66.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.987 0.115 . . . . 0.0 110.749 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -57.38 -43.92 84.01 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.184 1.394 . . . . 0.0 113.07 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -59.16 -54.08 51.06 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.194 0.998 . . . . 0.0 111.286 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -70.93 -19.43 62.58 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.744 -1.222 . . . . 0.0 113.087 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -73.14 -36.89 66.75 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.075 0.95 . . . . 0.0 111.117 169.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -82.42 -39.14 23.03 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.339 0.656 . . . . 0.0 112.27 -172.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.14 -28.1 12.87 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 177.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.71 -168.62 25.14 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.415 ' HB3' HG22 ' A' ' 163' ' ' THR . 41.8 Cg_endo -62.41 128.49 23.83 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.993 3.129 . . . . 0.0 114.006 -170.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -139.74 164.25 30.45 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.14 1.376 . . . . 0.0 111.09 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.4 mtt-85 -78.86 157.53 28.31 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 120.432 -1.418 . . . . 0.0 111.119 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.538 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -53.81 -32.76 53.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.597 0.759 . . . . 0.0 112.542 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.1 tp -64.9 -41.05 95.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.245 0.618 . . . . 0.0 111.684 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 31.6 t -60.66 -45.43 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -61.1 -44.07 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.428 0.691 . . . . 0.0 110.459 178.815 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.469 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.21 -54.98 38.79 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.131 1.372 . . . . 0.0 110.161 -177.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -64.27 -34.3 77.8 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.275 0.63 . . . . 0.0 111.959 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.71 -24.82 64.53 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.459 HD11 HG13 ' A' ' 113' ' ' ILE . 3.0 mt -90.51 -12.02 38.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.087 1.355 . . . . 0.0 113.301 170.126 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.55 11.65 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.129 1.347 . . . . 0.0 114.371 -178.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.3 mmt -84.0 176.13 9.06 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.036 1.734 . . . . 0.0 110.99 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -107.49 -35.64 6.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -171.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.9 p -133.34 157.22 46.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.608 1.163 . . . . 0.0 112.05 -171.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.15 -28.22 66.38 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 176.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.75 -28.95 68.82 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.741 1.216 . . . . 0.0 113.765 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.92 -28.36 68.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.949 0.404 . . . . 0.0 111.116 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.507 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -100.34 -31.19 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.706 0.802 . . . . 0.0 112.239 -174.403 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.07 -41.22 7.46 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.733 1.613 . . . . 0.0 112.617 -175.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -55.48 -42.86 74.96 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.63 1.172 . . . . 0.0 113.465 176.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -77.24 -43.46 33.42 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.072 0.949 . . . . 0.0 111.562 174.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.6 mt -59.08 -51.92 67.98 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.073 0.949 . . . . 0.0 112.433 -177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -34.71 78.29 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.327 0.651 . . . . 0.0 111.256 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.1 mtt-85 -64.24 -38.77 92.24 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.075 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 91.1 mtp -67.65 -35.49 78.98 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.155 0.982 . . . . 0.0 111.997 174.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -63.3 -38.62 91.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.787 -1.196 . . . . 0.0 113.132 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.3 t -68.96 -18.17 64.04 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -113.84 15.89 18.53 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.812 1.782 . . . . 0.0 115.812 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 72.02 38.43 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.328 1.451 . . . . 0.0 113.395 175.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -120.66 -32.83 3.94 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.978 1.711 . . . . 0.0 113.081 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -128.02 163.7 23.98 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.5 1.045 . . . . 0.0 113.781 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -147.69 115.45 6.4 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.959 2.103 . . . . 0.0 108.969 178.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.9 ttp -88.47 143.87 26.71 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.687 -0.633 . . . . 0.0 111.757 174.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -89.68 130.6 35.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.74 1.216 . . . . 0.0 109.619 170.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.97 -7.57 54.92 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.975 0.91 . . . . 0.0 113.016 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -88.72 -34.16 17.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.33 0.652 . . . . 0.0 112.548 -173.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.21 13.13 1.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.47 1.108 . . . . 0.0 113.78 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt 53.07 38.98 28.77 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 126.227 1.811 . . . . 0.0 113.265 -174.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.65 118.37 23.8 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.589 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -85.2 122.67 29.72 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.456 1.103 . . . . 0.0 110.866 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.415 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -127.24 129.44 47.78 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.752 1.621 . . . . 0.0 108.555 -176.938 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.74 128.86 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 110.813 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -68.27 90.56 0.35 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.792 1.237 . . . . 0.0 112.031 -177.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? . . . . . 0 C--O 1.253 1.286 0 C-N-CA 127.539 2.336 . . . . 0.0 111.346 176.986 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.79 -44.8 93.77 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.164 0.986 . . . . 0.0 110.585 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.88 -49.55 74.41 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.266 1.026 . . . . 0.0 112.45 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.63 -41.35 98.96 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.693 0.797 . . . . 0.0 113.028 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.477 HD11 HG12 ' A' ' 140' ' ' VAL . 45.6 mt -60.56 -49.55 83.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 124.231 1.012 . . . . 0.0 110.653 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.88 -50.67 69.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.668 0.387 . . . . 0.0 111.098 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -58.17 -44.46 88.0 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.351 1.46 . . . . 0.0 112.807 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -59.06 -53.34 59.46 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.951 0.9 . . . . 0.0 111.385 174.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.9 -18.69 62.66 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.773 -1.204 . . . . 0.0 113.104 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.4 ttmt -73.26 -36.0 66.29 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.69 0.796 . . . . 0.0 110.76 169.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.76 -38.34 21.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.403 0.681 . . . . 0.0 112.318 -171.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.93 -26.62 13.36 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 176.608 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.87 -167.25 26.68 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -172.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.433 ' HB3' HG22 ' A' ' 163' ' ' THR . 53.1 Cg_endo -63.86 128.2 21.43 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.943 3.095 . . . . 0.0 113.936 -170.1 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.6 mm-40 -139.52 164.65 29.34 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.27 1.428 . . . . 0.0 111.385 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -79.25 157.79 27.71 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.364 -1.46 . . . . 0.0 111.082 177.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.32 -32.74 57.36 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.456 0.702 . . . . 0.0 112.567 -179.541 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.0 tp -65.98 -39.65 90.53 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.197 0.599 . . . . 0.0 111.887 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 29.6 t -60.9 -45.06 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.531 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -61.6 -44.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.349 0.66 . . . . 0.0 110.639 178.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.448 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.71 -54.92 38.34 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 125.028 1.331 . . . . 0.0 110.028 -177.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.55 -33.41 75.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.216 0.606 . . . . 0.0 112.067 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.05 -25.16 64.32 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.465 HD11 HG13 ' A' ' 113' ' ' ILE . 2.4 mt -89.5 -12.06 41.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.209 1.404 . . . . 0.0 113.097 169.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.9 9.25 59.85 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 125.174 1.369 . . . . 0.0 114.276 -177.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.7 mmt -83.37 172.72 12.21 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.035 1.734 . . . . 0.0 111.06 174.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -107.96 -28.96 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -169.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.5 p -132.15 152.71 51.12 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.952 1.301 . . . . 0.0 111.739 -171.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.2 -29.77 65.94 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.99 0.916 . . . . 0.0 112.614 171.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -67.54 -23.69 65.46 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 127.231 2.213 . . . . 0.0 114.696 174.495 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -70.35 -28.65 65.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.792 0.724 . . . . 0.0 110.879 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.477 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -100.79 -31.51 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.276 0.63 . . . . 0.0 112.336 -171.977 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.42 -40.75 5.71 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.027 1.731 . . . . 0.0 113.021 -176.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -45.5 77.2 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.579 1.152 . . . . 0.0 112.852 175.701 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.98 -40.95 60.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.231 1.012 . . . . 0.0 112.012 174.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.0 -52.8 62.54 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.557 0.743 . . . . 0.0 112.173 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.04 -34.62 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.68 -0.637 . . . . 0.0 111.343 177.043 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -57.91 -48.06 81.0 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.45 0.3 . . . . 0.0 110.261 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -64.08 -35.6 81.28 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 124.325 1.05 . . . . 0.0 111.515 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -64.75 -37.12 86.54 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.983 -1.073 . . . . 0.0 113.689 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.1 t -71.55 -18.13 62.27 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -113.73 15.4 18.76 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.408 1.632 . . . . 0.0 115.408 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.64 39.27 0.89 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.502 1.521 . . . . 0.0 113.981 175.133 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.16 -32.63 3.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.177 1.791 . . . . 0.0 113.099 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.401 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -128.53 163.81 24.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.641 1.11 . . . . 0.0 113.665 176.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -148.79 115.24 5.89 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.795 2.038 . . . . 0.0 108.959 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -89.62 140.9 29.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.649 0.738 . . . . 0.0 111.76 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -102.05 107.0 17.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 126.259 1.823 . . . . 0.0 107.382 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.4 -8.88 20.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.089 1.356 . . . . 0.0 112.868 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -66.09 -32.83 74.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.68 1.992 . . . . 0.0 112.283 177.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.13 16.7 0.84 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 173.042 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.1 mptt 50.22 39.93 20.96 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.345 2.258 . . . . 0.0 113.384 -170.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.84 118.27 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.383 0.673 . . . . 0.0 109.866 174.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -83.4 127.05 33.37 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.333 1.453 . . . . 0.0 111.428 173.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.0 OUTLIER -132.81 129.54 38.66 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.859 1.664 . . . . 0.0 108.494 -174.581 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.39 129.52 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.497 -1.377 . . . . 0.0 111.301 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.1 88.01 0.41 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.046 1.338 . . . . 0.0 112.187 -177.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.845 2.058 . . . . 0.0 113.519 176.455 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -62.32 -45.78 91.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.291 0.567 . . . . 0.0 111.521 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.22 -48.93 75.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.718 0.807 . . . . 0.0 112.459 171.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.8 -46.21 88.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.005 0.922 . . . . 0.0 112.384 175.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.456 HD11 HG12 ' A' ' 140' ' ' VAL . 39.9 mt -57.73 -50.09 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 124.585 1.154 . . . . 0.0 110.948 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -65.09 -50.99 63.98 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.026 0.531 . . . . 0.0 110.893 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -56.7 -45.56 81.75 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.522 1.129 . . . . 0.0 111.968 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -58.44 -54.3 48.55 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.138 0.975 . . . . 0.0 111.434 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.4 mt -70.53 -18.9 62.94 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.861 -1.149 . . . . 0.0 113.359 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -74.34 -36.33 63.64 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.829 0.74 . . . . 0.0 111.423 169.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -81.77 -38.63 25.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.418 0.687 . . . . 0.0 112.322 -173.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.98 -29.03 12.78 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.66 -168.85 24.1 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -171.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.416 ' HB3' HG22 ' A' ' 163' ' ' THR . 48.7 Cg_endo -63.22 127.81 21.09 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.166 3.244 . . . . 0.0 114.126 -171.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -141.41 162.68 34.89 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.234 1.414 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -79.32 161.38 26.29 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 120.153 -1.592 . . . . 0.0 112.503 178.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.542 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.05 -32.39 64.01 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.244 0.618 . . . . 0.0 112.413 -179.182 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.6 tp -65.09 -41.58 94.88 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.789 -0.569 . . . . 0.0 111.365 177.312 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.5 t -59.34 -45.06 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.971 0.508 . . . . 0.0 109.896 174.345 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.542 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -63.73 -43.0 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.758 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.437 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.85 -54.78 40.33 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.13 1.372 . . . . 0.0 110.06 -178.731 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -63.93 -34.55 78.22 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.251 0.62 . . . . 0.0 111.939 -179.382 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.46 64.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 177.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.452 HD11 HG13 ' A' ' 113' ' ' ILE . 3.6 mt -88.48 -11.88 44.6 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.567 1.547 . . . . 0.0 113.256 170.005 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.99 10.86 60.81 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.697 1.141 . . . . 0.0 114.144 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.0 mmt -83.47 175.32 9.89 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.988 1.715 . . . . 0.0 110.859 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -107.8 -34.62 6.9 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -171.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 63.0 p -132.45 156.78 46.12 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.584 1.154 . . . . 0.0 112.181 -171.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.17 66.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 113.732 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.95 -29.73 69.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.913 1.285 . . . . 0.0 113.773 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -67.2 -23.97 65.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.861 0.362 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.456 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.77 -30.93 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.98 0.912 . . . . 0.0 112.598 -176.235 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.89 -40.62 14.4 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.326 1.45 . . . . 0.0 112.747 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -44.34 77.94 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.495 1.118 . . . . 0.0 112.744 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.64 -42.8 60.92 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.807 1.243 . . . . 0.0 111.814 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.2 mt -62.44 -51.52 67.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.981 0.913 . . . . 0.0 112.306 -176.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.68 -34.56 78.13 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.27 0.628 . . . . 0.0 110.792 178.225 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 83.1 mtt-85 -65.64 -37.26 86.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.492 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.7 mtp -68.83 -34.05 74.85 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.066 0.946 . . . . 0.0 111.874 173.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.5 tttp -64.09 -38.66 91.86 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.581 -1.324 . . . . 0.0 112.803 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.95 -14.61 62.79 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 175.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -114.08 14.83 18.39 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 175.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 72.06 38.51 0.89 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.363 1.465 . . . . 0.0 113.417 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -120.39 -32.86 4.0 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.767 1.627 . . . . 0.0 113.19 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.446 HD11 ' CG2' ' A' ' 113' ' ' ILE . 10.9 mt -128.08 163.44 24.6 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 176.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -150.23 115.37 5.39 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.165 1.786 . . . . 0.0 109.788 177.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 48.9 ttp -84.09 145.97 28.16 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.802 -0.561 . . . . 0.0 111.8 174.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -96.15 127.47 42.19 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 125.239 1.415 . . . . 0.0 109.135 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -71.14 -13.83 62.08 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.178 -0.951 . . . . 0.0 112.377 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -83.82 -37.34 22.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.678 1.191 . . . . 0.0 113.251 -169.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 6.3 t -134.16 8.11 3.71 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.196 1.398 . . . . 0.0 112.629 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm 51.53 40.18 26.38 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 127.053 2.141 . . . . 0.0 113.328 -170.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.31 120.38 28.54 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.612 -177.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -82.09 124.81 30.17 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.528 1.131 . . . . 0.0 110.801 172.491 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.416 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.5 p -130.36 128.0 40.54 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 108.465 -173.312 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.37 128.62 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 120.466 -1.397 . . . . 0.0 110.9 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -67.43 90.35 0.24 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.797 1.239 . . . . 0.0 111.89 -178.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 126.853 2.061 . . . . 0.0 112.475 179.012 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 . . . . . 0 N--CA 1.474 0.739 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -62.28 -45.69 92.13 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.708 0.803 . . . . 0.0 111.39 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.41 -48.55 76.71 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.912 0.885 . . . . 0.0 112.971 170.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.46 -44.41 95.89 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.061 0.944 . . . . 0.0 112.595 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.53 HD11 HG12 ' A' ' 140' ' ' VAL . 32.9 mt -57.97 -49.52 80.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 124.751 1.22 . . . . 0.0 110.799 178.458 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -64.28 -50.05 69.43 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.071 0.548 . . . . 0.0 110.711 -177.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -54.58 -51.42 65.34 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.188 0.995 . . . . 0.0 111.971 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -54.56 -52.0 63.45 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 123.851 0.86 . . . . 0.0 111.538 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.32 -19.89 61.58 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.943 -1.098 . . . . 0.0 113.004 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -73.05 -34.27 66.18 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.846 0.858 . . . . 0.0 110.704 169.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.63 -39.0 20.82 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.972 0.909 . . . . 0.0 111.706 -170.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.93 -27.93 11.87 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 176.001 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 98.49 -169.81 23.88 Favored Glycine 0 N--CA 1.474 1.186 0 CA-C-O 118.785 -1.008 . . . . 0.0 110.644 -171.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.4 ' HB3' HG22 ' A' ' 163' ' ' THR . 35.6 Cg_endo -61.5 129.53 28.42 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.985 3.124 . . . . 0.0 114.122 -171.536 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -139.76 164.82 28.94 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.304 1.442 . . . . 0.0 110.785 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.12 158.29 26.42 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.33 -1.481 . . . . 0.0 111.068 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.53 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.13 -33.2 57.23 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.445 0.698 . . . . 0.0 112.605 -178.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.88 -39.93 91.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.178 0.591 . . . . 0.0 111.848 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.0 t -60.31 -45.91 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.53 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -61.05 -43.4 96.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.364 0.665 . . . . 0.0 110.528 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.523 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.42 -54.33 48.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.636 1.175 . . . . 0.0 110.077 -177.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -65.28 -33.16 75.32 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.987 0.515 . . . . 0.0 112.061 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.93 -25.71 64.71 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.479 HD11 HG13 ' A' ' 113' ' ' ILE . 3.0 mt -88.6 -11.27 45.97 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.249 1.419 . . . . 0.0 113.319 169.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.84 11.54 61.65 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.762 1.172 . . . . 0.0 114.236 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.2 mtt -80.52 176.21 9.99 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.007 1.723 . . . . 0.0 111.211 171.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -108.14 -35.96 6.43 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.4 p -125.64 152.2 45.5 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.024 1.33 . . . . 0.0 112.312 -170.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.12 -29.09 68.39 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -64.13 -28.58 69.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.935 2.094 . . . . 0.0 114.453 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -72.26 -20.62 61.5 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.822 0.737 . . . . 0.0 111.439 177.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.53 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.48 -30.57 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.539 -0.725 . . . . 0.0 112.651 -177.157 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.07 -40.28 31.06 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.379 1.472 . . . . 0.0 112.389 -173.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -52.38 -50.17 62.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.682 1.193 . . . . 0.0 111.817 173.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -71.15 -41.76 70.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.009 1.324 . . . . 0.0 111.654 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.03 -52.9 61.06 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.109 0.963 . . . . 0.0 111.916 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -33.04 74.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.776 0.83 . . . . 0.0 111.302 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 48.0 mtp85 -61.52 -43.07 99.53 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.923 174.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.1 mtp -69.71 -33.18 72.15 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.997 0.919 . . . . 0.0 111.809 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -62.8 -42.23 99.62 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.488 -1.382 . . . . 0.0 112.408 170.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.9 m -69.18 -13.85 62.65 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 178.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -114.08 14.89 18.39 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 72.77 38.46 0.75 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.361 1.464 . . . . 0.0 113.588 176.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.1 mp -121.51 -31.9 3.94 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.731 1.612 . . . . 0.0 113.368 -178.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.445 HD11 ' CG2' ' A' ' 113' ' ' ILE . 10.0 mt -127.35 164.19 22.34 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.565 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -148.38 115.84 6.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.809 1.643 . . . . 0.0 110.259 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -86.15 144.27 27.58 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.343 -0.848 . . . . 0.0 112.034 174.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.37 130.61 34.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.71 1.204 . . . . 0.0 109.236 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -73.82 -9.34 58.55 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 124.679 1.192 . . . . 0.0 112.878 176.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -90.79 -39.1 12.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -174.007 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.64 15.12 2.34 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.72 40.84 31.11 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 126.162 1.785 . . . . 0.0 113.045 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.42 117.35 23.58 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.47 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.52 122.32 28.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.197 0.999 . . . . 0.0 110.637 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.4 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.2 OUTLIER -126.46 131.17 51.72 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 125.513 1.525 . . . . 0.0 108.434 -178.438 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -52.23 133.33 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.115 -0.991 . . . . 0.0 110.702 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -70.26 102.12 2.05 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 111.193 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.707 2.003 . . . . 0.0 112.758 173.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 . . . . . 0 N--CA 1.474 0.733 0 CA-C-O 118.698 -0.668 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -53.87 -48.65 69.82 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.873 0.76 . . . . 0.0 112.061 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.56 -51.25 70.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.018 0.927 . . . . 0.0 112.155 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.09 -42.33 99.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 118.589 -0.72 . . . . 0.0 112.262 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.475 HD11 HG12 ' A' ' 140' ' ' VAL . 49.5 mt -57.75 -51.31 71.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.66 1.118 . . . . 0.0 111.256 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -65.26 -49.3 70.14 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.124 0.57 . . . . 0.0 110.423 -176.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.7 tpt85 -58.59 -43.86 89.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.559 1.144 . . . . 0.0 112.825 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -60.75 -53.85 52.33 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 124.756 1.222 . . . . 0.0 111.558 175.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.21 -19.54 63.96 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.957 -1.089 . . . . 0.0 112.705 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -73.84 -35.48 64.82 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.729 0.695 . . . . 0.0 111.482 169.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -77.72 -41.37 38.09 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.158 0.583 . . . . 0.0 111.957 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.58 -28.01 11.99 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -178.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.29 -166.7 24.51 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -172.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.453 ' HB3' HG22 ' A' ' 163' ' ' THR . 47.8 Cg_endo -62.97 125.91 16.91 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.896 3.064 . . . . 0.0 114.124 -169.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -139.13 162.24 35.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.205 1.402 . . . . 0.0 110.973 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -81.12 160.25 24.48 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.282 -1.511 . . . . 0.0 112.032 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.2 -32.8 62.51 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.6 0.636 . . . . 0.0 112.522 -177.227 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.7 tp -65.74 -40.87 92.59 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.957 -0.464 . . . . 0.0 111.493 177.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.1 t -59.14 -46.35 92.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.169 0.587 . . . . 0.0 109.638 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.531 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -62.26 -43.36 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.834 0.853 . . . . 0.0 110.547 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.492 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -58.06 -53.88 53.23 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.504 1.121 . . . . 0.0 110.185 -178.148 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.04 -34.31 77.73 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.072 0.549 . . . . 0.0 111.984 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.91 -26.33 65.93 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.422 0.689 . . . . 0.0 112.833 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.467 HD11 HG13 ' A' ' 113' ' ' ILE . 4.1 mt -86.35 -11.94 50.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.658 1.583 . . . . 0.0 113.19 169.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.94 11.15 61.95 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.831 1.205 . . . . 0.0 113.801 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 29.2 mtt -80.86 176.91 9.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.508 1.923 . . . . 0.0 111.228 173.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -108.04 -37.35 6.09 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -176.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -128.29 155.02 45.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.593 1.157 . . . . 0.0 112.52 -170.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.76 -24.94 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.31 1.044 . . . . 0.0 113.464 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.08 -28.91 68.57 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.728 1.211 . . . . 0.0 113.324 174.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -72.77 -15.66 61.65 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 118.383 0.538 . . . . 0.0 112.267 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.492 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -108.57 -31.06 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.017 0.927 . . . . 0.0 113.001 178.777 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.56 -41.11 53.81 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.07 1.348 . . . . 0.0 112.376 -172.518 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -55.4 -41.58 72.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.212 1.005 . . . . 0.0 112.639 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.51 -46.71 25.43 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.313 1.045 . . . . 0.0 111.49 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 84.2 mt -57.09 -51.94 67.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.493 1.117 . . . . 0.0 112.333 -178.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 -35.13 77.57 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.071 0.548 . . . . 0.0 111.247 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -64.43 -40.51 95.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 118.467 -0.777 . . . . 0.0 110.767 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.41 ' HA ' ' HG2' ' A' ' 150' ' ' ARG . 87.5 mtp -66.14 -34.8 78.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.673 1.189 . . . . 0.0 111.419 175.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.3 tttm -63.66 -40.28 96.45 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.531 -1.356 . . . . 0.0 113.112 169.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.69 -14.12 62.64 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 175.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' ARG . . . . . 0.41 ' HG2' ' HA ' ' A' ' 147' ' ' MET . 13.9 ptm180 -114.11 14.7 18.32 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.5 t-80 72.11 37.84 0.95 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.531 1.533 . . . . 0.0 113.624 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -120.09 -32.61 4.14 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.657 1.583 . . . . 0.0 113.099 -179.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -127.92 164.08 23.06 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -148.79 115.41 5.94 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.972 2.109 . . . . 0.0 109.178 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.5 ttp -88.8 144.03 26.51 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.569 -0.707 . . . . 0.0 112.147 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.94 129.78 37.83 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.446 1.498 . . . . 0.0 110.102 171.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -74.16 -7.3 52.15 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 123.975 0.91 . . . . 0.0 113.147 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.87 -35.93 21.89 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.657 0.783 . . . . 0.0 112.865 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 2.1 t -144.47 15.77 1.64 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt 54.27 39.44 30.84 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.094 1.757 . . . . 0.0 113.306 -171.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -82.34 119.0 23.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.387 0.675 . . . . 0.0 109.857 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -86.18 123.19 31.19 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.025 1.33 . . . . 0.0 110.601 175.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.453 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -126.95 129.03 47.35 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 125.709 1.604 . . . . 0.0 108.083 -176.291 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.76 129.79 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 120.851 -1.155 . . . . 0.0 110.474 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.51 91.07 0.56 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.432 1.093 . . . . 0.0 111.255 -179.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 126.615 1.966 . . . . 0.0 112.056 177.86 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 111.321 0.119 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -61.36 -49.24 77.75 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.664 1.185 . . . . 0.0 112.389 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.64 -46.7 73.99 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.629 1.172 . . . . 0.0 112.484 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.01 -43.73 94.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.793 173.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 140' ' ' VAL . 42.0 mt -56.7 -49.66 77.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.679 1.127 . . . . 0.0 111.446 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -64.14 -53.17 53.78 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.017 0.527 . . . . 0.0 110.61 -177.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.2 ttp85 -57.75 -42.61 84.32 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.862 1.265 . . . . 0.0 113.019 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -58.95 -54.03 51.73 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.288 1.035 . . . . 0.0 111.462 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.55 -18.81 62.92 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.75 -1.219 . . . . 0.0 113.137 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -73.04 -35.01 66.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 110.924 169.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.34 -39.26 17.85 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.405 0.682 . . . . 0.0 112.438 -172.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.59 -26.44 13.83 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.82 -167.4 26.85 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -173.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' PRO . . . . . 0.438 ' HB3' HG22 ' A' ' 163' ' ' THR . 44.0 Cg_endo -62.49 126.23 17.94 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.947 3.098 . . . . 0.0 113.821 -170.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -139.33 162.6 34.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.035 1.334 . . . . 0.0 110.857 179.156 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 54.3 mtt85 -80.69 159.75 25.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.36 -1.463 . . . . 0.0 111.955 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ALA . . . . . 0.525 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.72 -33.11 60.63 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.35 0.66 . . . . 0.0 112.552 -177.538 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.01 -41.9 94.94 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.971 -0.456 . . . . 0.0 111.582 177.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.0 -45.78 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.238 0.615 . . . . 0.0 109.691 174.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.525 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.92 -44.29 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 123.783 0.833 . . . . 0.0 110.344 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.512 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.8 -54.39 46.96 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.924 1.29 . . . . 0.0 110.194 -177.127 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -63.47 -34.44 77.76 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.357 0.663 . . . . 0.0 112.007 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.37 -24.73 63.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.443 HD11 HG13 ' A' ' 113' ' ' ILE . 4.3 mt -88.9 -11.83 43.45 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.642 1.577 . . . . 0.0 113.428 170.119 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.54 11.3 58.33 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.106 1.336 . . . . 0.0 113.991 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 30.5 mtt -81.33 177.03 9.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 111.29 173.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.94 -36.6 6.31 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 64.2 p -131.54 155.79 46.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.736 1.214 . . . . 0.0 112.572 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.57 -28.6 67.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.469 1.108 . . . . 0.0 113.523 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -66.09 -28.39 68.78 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 113.197 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -73.46 -15.34 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' VAL . . . . . 0.533 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -108.11 -30.83 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.532 1.133 . . . . 0.0 113.192 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.95 -40.71 31.41 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.283 1.433 . . . . 0.0 112.406 -173.083 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -54.82 -40.86 70.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.511 1.124 . . . . 0.0 112.989 175.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -77.23 -46.46 23.14 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 176.036 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.48 -51.77 68.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.394 1.077 . . . . 0.0 112.127 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -33.14 74.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.636 0.774 . . . . 0.0 111.621 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.3 mtp-105 -70.17 -32.28 70.15 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.963 -0.46 . . . . 0.0 112.152 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -73.68 -34.09 64.72 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.663 1.185 . . . . 0.0 111.458 171.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -62.67 -42.52 99.66 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.236 -1.54 . . . . 0.0 112.047 171.156 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.1 m -67.05 -13.58 62.06 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' ARG . . . . . 0.422 ' HG3' HD13 ' A' ' 152' ' ' LEU . 4.8 ptp180 -113.97 14.93 18.54 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 176.257 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.03 38.4 0.91 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.667 1.587 . . . . 0.0 112.94 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' LEU . . . . . 0.422 HD13 ' HG3' ' A' ' 150' ' ' ARG . 5.4 mp -121.52 -32.48 3.82 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.636 1.174 . . . . 0.0 113.752 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -123.89 164.65 18.84 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.158 0.983 . . . . 0.0 113.227 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.2 115.38 5.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.799 2.04 . . . . 0.0 108.854 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.1 ttp -88.43 143.52 26.94 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.708 -0.62 . . . . 0.0 111.9 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -90.21 130.77 36.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.018 1.327 . . . . 0.0 109.841 171.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.65 -9.12 58.34 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 123.899 0.88 . . . . 0.0 113.014 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -86.45 -36.46 19.07 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -172.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.9 t -143.09 15.86 1.9 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.049 0.94 . . . . 0.0 113.488 176.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 54.0 40.6 31.77 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.12 1.768 . . . . 0.0 113.307 -172.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.92 119.96 25.52 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.591 0.757 . . . . 0.0 109.875 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -86.09 123.82 31.82 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.06 1.344 . . . . 0.0 110.824 174.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.438 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -128.33 130.24 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.706 1.602 . . . . 0.0 108.743 -175.873 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.81 126.43 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 120.756 -1.215 . . . . 0.0 110.598 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.89 95.62 0.26 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.146 . . . . 0.0 112.48 -177.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.199 2.6 . . . . 0.0 113.559 171.192 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.3 m . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -96.93 -14.49 21.7 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -177.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 84.3 mtp -90.69 165.2 13.83 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.932 1.293 . . . . 0.0 112.371 177.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.31 150.14 43.99 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.114 0.966 . . . . 0.0 112.917 177.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.7 p -84.73 -32.3 0.48 Allowed Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 117.793 2.516 . . . . 0.0 117.793 -170.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -83.62 165.98 13.78 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 CA-C-N 123.287 2.21 . . . . 0.0 112.427 -175.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.3 mm100 -124.24 117.0 23.58 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.296 1.838 . . . . 0.0 110.924 176.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -105.99 143.17 34.51 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.245 1.018 . . . . 0.0 111.861 171.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 74.5 m -88.02 -30.63 19.82 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.173 1.389 . . . . 0.0 112.961 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -155.19 168.3 27.51 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.77 1.228 . . . . 0.0 112.298 -172.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -52.98 -35.83 59.61 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.856 1.262 . . . . 0.0 113.005 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 48.6 mtt180 -60.88 -53.92 51.39 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.437 1.017 . . . . 0.0 111.684 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -59.43 -45.65 90.98 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.72 1.208 . . . . 0.0 111.839 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -58.3 -43.61 88.18 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.452 1.101 . . . . 0.0 112.786 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.67 -42.74 86.09 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.207 -0.933 . . . . 0.0 112.944 173.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.542 HD11 HG12 ' A' ' 140' ' ' VAL . 27.3 mt -55.52 -49.28 74.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.44 -53.56 50.39 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.176 0.59 . . . . 0.0 110.752 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -56.01 -44.36 78.6 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.967 1.307 . . . . 0.0 113.493 178.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -58.89 -54.22 49.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.389 1.076 . . . . 0.0 111.237 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.87 -18.96 62.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.821 -1.174 . . . . 0.0 113.187 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -73.36 -36.26 66.08 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.812 0.845 . . . . 0.0 111.294 169.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.46 -39.24 20.79 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.412 0.685 . . . . 0.0 112.408 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.05 -28.39 13.08 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.93 -168.74 24.91 Favored Glycine 0 N--CA 1.469 0.9 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 -172.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.433 ' HB3' HG22 ' A' ' 163' ' ' THR . 47.7 Cg_endo -62.96 128.26 22.56 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 124.004 3.136 . . . . 0.0 113.842 -170.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -139.97 163.17 33.39 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.07 1.348 . . . . 0.0 111.053 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -80.5 159.29 25.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.364 -1.46 . . . . 0.0 111.51 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.511 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.58 -33.52 60.41 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.558 0.743 . . . . 0.0 112.505 -177.279 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.25 -41.05 94.68 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.265 0.626 . . . . 0.0 111.627 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.6 t -59.44 -45.82 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.431 0.692 . . . . 0.0 109.154 174.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.511 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.99 -43.26 97.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.492 0.717 . . . . 0.0 110.67 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.553 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.46 -54.54 45.63 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.718 1.207 . . . . 0.0 110.044 -177.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -63.87 -34.61 78.32 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.325 0.65 . . . . 0.0 111.974 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.67 -25.39 64.78 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 113' ' ' ILE . 3.7 mt -89.36 -11.98 41.76 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.475 1.51 . . . . 0.0 113.437 170.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.7 11.46 59.17 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.674 1.13 . . . . 0.0 114.204 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.1 mtt -80.08 176.88 9.35 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.043 1.737 . . . . 0.0 110.982 171.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -107.96 -38.14 5.89 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -175.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 60.0 p -129.33 155.75 45.12 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.347 -170.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.52 -28.07 66.74 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.53 -27.6 67.11 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.77 1.228 . . . . 0.0 113.472 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.17 -22.47 62.96 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.301 0.5 . . . . 0.0 111.457 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.553 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -103.25 -30.31 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 O-C-N 121.634 -0.667 . . . . 0.0 112.693 -177.756 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.41 -39.51 32.96 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.265 1.426 . . . . 0.0 112.498 -172.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -53.49 -49.82 66.69 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.272 1.029 . . . . 0.0 111.823 173.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -70.37 -42.25 72.05 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.006 1.322 . . . . 0.0 111.666 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.93 -52.87 61.37 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.843 0.857 . . . . 0.0 111.983 -177.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -33.23 75.01 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.433 0.693 . . . . 0.0 111.087 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.4 mtp85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.053 0.388 . . . . 0.0 110.887 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.94 -32.73 71.15 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.157 0.983 . . . . 0.0 111.939 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -64.45 -39.43 93.8 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.464 -1.398 . . . . 0.0 112.918 169.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.5 t -68.35 -14.37 62.94 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -115.53 15.99 16.61 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 115.853 1.797 . . . . 0.0 115.853 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.85 38.51 0.93 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.465 1.506 . . . . 0.0 113.162 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 6.6 mp -121.22 -32.26 3.93 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.507 1.523 . . . . 0.0 113.391 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.472 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -126.8 163.42 23.61 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.163 0.892 . . . . 0.0 113.057 175.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -148.35 117.45 6.82 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.007 1.723 . . . . 0.0 109.187 176.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -85.31 143.03 28.93 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.98 -0.45 . . . . 0.0 111.416 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -87.1 131.04 34.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.966 1.306 . . . . 0.0 109.413 170.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -70.96 -14.59 62.42 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.977 0.911 . . . . 0.0 112.365 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -83.33 -40.79 19.02 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.659 0.783 . . . . 0.0 112.604 -170.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.2 t -138.93 15.21 2.66 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.506 1.122 . . . . 0.0 113.703 178.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 53.1 40.65 31.57 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.404 1.481 . . . . 0.0 112.813 -174.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.52 119.13 24.82 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.453 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -84.68 124.87 31.98 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.59 1.156 . . . . 0.0 110.925 175.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.0 OUTLIER -130.83 129.2 42.05 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.58 1.552 . . . . 0.0 108.542 -174.277 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.56 127.82 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 120.707 -1.245 . . . . 0.0 110.788 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -66.88 91.65 0.21 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.771 1.228 . . . . 0.0 112.41 -176.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 . . . . . 0 C--O 1.255 1.358 0 C-N-CA 128.484 2.713 . . . . 0.0 113.379 176.146 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.451 ' CG ' ' H ' ' A' ' 100' ' ' MET . 19.3 t-80 -134.4 -171.09 2.67 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.193 1.397 . . . . 0.0 111.688 177.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.451 ' H ' ' CG ' ' A' ' 99' ' ' HIS . 66.2 mtt -66.65 153.51 42.93 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.479 1.512 . . . . 0.0 113.211 -174.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.28 20.86 2.61 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.38 1.472 . . . . 0.0 113.88 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 45.3 m -156.08 153.42 25.52 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 126.238 1.815 . . . . 0.0 110.888 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -74.97 175.54 11.09 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.563 2.842 . . . . 0.0 113.158 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -123.56 112.79 17.87 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.271 1.828 . . . . 0.0 108.332 169.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -79.33 148.64 32.0 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -169.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 6.2 t -76.88 -34.37 57.77 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 176.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -150.74 166.64 29.8 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -45.14 -44.78 10.92 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 126.569 1.948 . . . . 0.0 113.26 176.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -62.64 -40.08 95.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -64.59 -42.71 95.42 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.173 0.989 . . . . 0.0 110.311 -177.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -62.53 -49.4 75.5 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.953 0.901 . . . . 0.0 112.002 171.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.54 -45.95 84.47 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.822 0.849 . . . . 0.0 112.52 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 140' ' ' VAL . 29.3 mt -59.84 -50.18 81.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.213 1.005 . . . . 0.0 110.86 179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -64.71 -48.33 75.05 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.842 0.457 . . . . 0.0 110.813 -177.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.4 tpt85 -58.7 -44.58 90.36 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.924 1.29 . . . . 0.0 112.773 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.93 -52.99 62.7 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.678 1.191 . . . . 0.0 111.55 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.77 -19.33 63.51 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.99 -1.069 . . . . 0.0 112.648 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -72.89 -34.74 66.87 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.443 0.697 . . . . 0.0 110.82 169.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.81 -41.38 26.57 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.216 0.607 . . . . 0.0 112.098 -173.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -27.95 12.37 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.41 -167.43 24.78 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.316 -1.113 . . . . 0.0 110.316 -171.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -64.86 127.74 19.3 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.68 2.92 . . . . 0.0 114.322 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -139.42 163.25 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.446 1.499 . . . . 0.0 110.889 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -81.14 162.31 23.72 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 120.172 -1.58 . . . . 0.0 112.46 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.516 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.05 -32.04 63.7 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.364 0.666 . . . . 0.0 112.649 -178.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.55 -41.14 89.11 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.939 -0.475 . . . . 0.0 111.41 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.86 -45.38 91.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.976 0.511 . . . . 0.0 109.768 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.516 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -64.0 -42.65 96.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.629 0.772 . . . . 0.0 110.686 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.467 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.96 -54.44 44.79 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.713 1.205 . . . . 0.0 110.002 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -64.28 -33.85 76.77 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.222 0.609 . . . . 0.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.74 -24.77 63.59 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.094 0.775 . . . . 0.0 113.094 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.2 mt -89.66 -11.94 41.03 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.351 1.46 . . . . 0.0 113.118 169.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.93 11.05 60.68 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.781 1.181 . . . . 0.0 114.136 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.06 174.98 10.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.915 1.686 . . . . 0.0 110.803 172.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -107.79 -33.97 7.1 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.3 p -133.42 156.25 48.04 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.587 1.155 . . . . 0.0 112.239 -171.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.13 -27.94 66.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.376 1.07 . . . . 0.0 113.581 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.46 -26.38 65.47 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.982 1.313 . . . . 0.0 113.702 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -69.04 -24.1 64.14 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.424 0.556 . . . . 0.0 111.345 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.533 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.25 -30.95 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 123.868 0.867 . . . . 0.0 112.659 -174.765 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.99 -41.1 15.71 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 125.325 1.45 . . . . 0.0 112.408 -175.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.17 -44.08 71.18 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.541 1.137 . . . . 0.0 112.9 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.02 -43.17 55.24 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.628 1.171 . . . . 0.0 112.135 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -62.45 -51.81 66.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.72 0.808 . . . . 0.0 112.313 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -34.4 77.59 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.669 0.788 . . . . 0.0 110.903 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 2.4 mtm105 -61.39 -44.16 97.62 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.007 0.367 . . . . 0.0 110.595 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.76 -34.56 78.61 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.907 0.883 . . . . 0.0 111.394 177.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -65.29 -37.64 87.77 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.849 -1.157 . . . . 0.0 113.503 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.67 -18.52 63.57 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -113.72 15.71 18.71 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.32 39.22 0.96 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.451 1.501 . . . . 0.0 113.965 174.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.96 -32.11 3.79 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.228 1.811 . . . . 0.0 113.246 -178.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.444 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.7 mt -129.31 164.28 23.87 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.417 1.008 . . . . 0.0 113.47 176.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -148.85 118.23 6.9 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.52 1.928 . . . . 0.0 109.505 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -87.67 142.48 27.8 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.964 -1.085 . . . . 0.0 112.154 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.01 116.12 31.39 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 126.193 1.797 . . . . 0.0 108.001 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.42 -6.92 39.17 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.916 0.887 . . . . 0.0 112.693 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.7 mp0 -69.44 -33.78 73.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.407 1.883 . . . . 0.0 112.444 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 4.4 t -148.83 14.53 0.93 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.059 1.344 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 51.35 35.88 14.99 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 127.68 2.392 . . . . 0.0 113.28 -169.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.45 119.55 25.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.677 0.791 . . . . 0.0 110.35 -174.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -82.3 121.75 27.06 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.926 1.29 . . . . 0.0 111.091 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.75 133.6 54.92 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.164 1.786 . . . . 0.0 109.506 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.35 127.41 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.451 -1.406 . . . . 0.0 110.476 174.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.43 92.75 0.21 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.646 1.179 . . . . 0.0 111.838 -177.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.274 0 C-N-CA 127.539 2.336 . . . . 0.0 112.001 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.4 m . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.0 p-80 -143.1 172.65 12.43 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.226 -178.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 77.7 mtm -123.95 149.58 45.78 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.192 1.397 . . . . 0.0 111.806 177.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.47 51.74 2.31 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.192 1.397 . . . . 0.0 113.247 -173.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 22.6 t -145.75 135.83 11.87 Favored Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 125.15 1.38 . . . . 0.0 111.191 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -78.36 169.79 19.52 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.539 2.826 . . . . 0.0 113.041 -177.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -124.26 110.27 14.42 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.263 1.825 . . . . 0.0 109.167 169.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -76.31 140.5 41.52 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -172.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 4.0 m -76.85 -31.81 57.11 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.709 0.803 . . . . 0.0 112.874 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -153.31 166.84 31.34 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.346 1.858 . . . . 0.0 110.349 175.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.82 -27.95 69.67 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -172.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -59.61 -41.33 90.12 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.873 0.761 . . . . 0.0 112.192 171.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -64.27 -39.13 93.3 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.777 0.831 . . . . 0.0 109.699 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -65.15 -51.7 59.58 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.972 0.509 . . . . 0.0 111.909 169.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.27 88.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.698 0.681 . . . . 0.0 111.891 -178.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.51 HD11 HG12 ' A' ' 140' ' ' VAL . 30.2 mt -58.34 -53.47 45.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.174 0.99 . . . . 0.0 110.643 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -61.42 -48.66 80.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.876 0.369 . . . . 0.0 111.256 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -64.32 -42.88 96.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.572 1.549 . . . . 0.0 112.427 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -60.57 -45.04 95.39 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.793 0.837 . . . . 0.0 112.4 174.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.409 ' CD1' HD21 ' A' ' 153' ' ' LEU . 82.7 mt -75.25 -25.5 58.11 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 121.355 -0.841 . . . . 0.0 112.725 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -69.12 -40.88 78.04 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.275 1.03 . . . . 0.0 110.4 169.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -75.39 -42.37 53.97 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -109.33 -16.98 13.91 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -173.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 100.89 -168.32 20.26 Favored Glycine 0 N--CA 1.466 0.67 0 C-N-CA 125.101 1.334 . . . . 0.0 110.557 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -63.09 127.37 20.07 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.757 2.305 . . . . 0.0 112.004 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -136.77 163.35 30.83 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.686 1.194 . . . . 0.0 110.712 176.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.4 mtt85 -80.79 160.48 24.85 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 120.194 -1.566 . . . . 0.0 111.726 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.528 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.94 -31.99 63.42 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -176.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.5 tp -65.62 -42.06 92.0 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.709 0.404 . . . . 0.0 111.31 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.27 -45.18 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.07 0.548 . . . . 0.0 109.575 174.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.528 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -63.38 -42.22 95.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 123.603 0.761 . . . . 0.0 110.542 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.452 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.44 -54.27 45.85 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.601 1.16 . . . . 0.0 109.827 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -65.64 -33.5 76.05 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.051 0.54 . . . . 0.0 112.138 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.27 -24.41 64.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.674 0.789 . . . . 0.0 112.87 176.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.41 HD11 HG13 ' A' ' 113' ' ' ILE . 3.2 mt -90.96 -11.96 37.4 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.064 1.745 . . . . 0.0 113.472 170.064 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.16 10.88 61.94 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.696 1.141 . . . . 0.0 114.307 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.24 175.72 9.7 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.017 1.727 . . . . 0.0 110.807 172.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -106.48 -35.01 7.21 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -134.16 156.99 47.35 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.431 1.092 . . . . 0.0 112.445 -170.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.5 -27.32 64.35 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.423 1.089 . . . . 0.0 113.7 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.42 -22.57 61.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.679 1.591 . . . . 0.0 114.129 176.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -70.86 -25.83 62.99 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.693 0.678 . . . . 0.0 111.14 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.51 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -104.85 -31.47 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.986 0.914 . . . . 0.0 112.692 -173.054 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -46.71 -38.23 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.559 1.544 . . . . 0.0 113.224 -175.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.38 -50.07 70.69 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.284 1.433 . . . . 0.0 112.107 174.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ASP . . . . . 0.413 ' HB3' HD12 ' A' ' 113' ' ' ILE . 8.9 m-20 -70.1 -41.29 74.22 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.828 1.251 . . . . 0.0 111.601 176.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.07 -53.35 51.16 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.332 0.653 . . . . 0.0 112.276 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.4 -31.72 72.13 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.647 0.779 . . . . 0.0 111.106 177.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -60.16 -47.77 84.55 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.184 0.447 . . . . 0.0 110.489 172.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.3 mtp -64.9 -34.32 78.12 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.198 0.999 . . . . 0.0 111.368 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -63.77 -40.57 97.01 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.868 -1.145 . . . . 0.0 113.038 170.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.5 m -72.24 -13.74 61.6 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -113.91 14.98 18.62 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 174.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 72.02 39.21 0.83 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.541 1.537 . . . . 0.0 114.038 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.38 -31.57 3.78 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.118 1.767 . . . . 0.0 113.366 -178.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.477 HD11 ' CG2' ' A' ' 113' ' ' ILE . 12.5 mt -128.77 163.66 24.7 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.71 1.141 . . . . 0.0 113.967 176.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -148.08 121.59 9.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.367 1.867 . . . . 0.0 109.424 175.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 46.6 ttp -90.35 145.81 24.67 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.293 -0.88 . . . . 0.0 112.427 173.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -93.23 128.32 39.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.162 1.385 . . . . 0.0 109.053 170.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.64 -14.47 62.49 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 121.19 -0.944 . . . . 0.0 112.295 177.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -80.58 -38.53 29.29 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.69 1.196 . . . . 0.0 113.151 -169.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -138.6 14.73 2.73 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.27 1.028 . . . . 0.0 113.084 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.668 1.987 . . . . 0.0 113.181 -174.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -90.05 119.61 30.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.069 0.948 . . . . 0.0 110.457 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -87.67 118.32 27.08 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.634 1.574 . . . . 0.0 111.631 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -117.67 136.64 53.19 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.442 1.897 . . . . 0.0 112.012 172.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' ILE . . . . . 0.409 HG12 ' H ' ' A' ' 164' ' ' ILE . 0.4 OUTLIER -54.32 127.37 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.314 1.446 . . . . 0.0 111.084 174.02 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -66.41 89.6 0.14 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.092 1.357 . . . . 0.0 112.523 -176.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 128.041 2.536 . . . . 0.0 112.565 176.797 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.7 p-80 -76.98 160.94 28.75 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.486 1.115 . . . . 0.0 112.569 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 14.8 tpt -86.94 129.34 34.92 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.951 0.9 . . . . 0.0 111.259 174.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -153.47 134.65 14.09 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.99 1.316 . . . . 0.0 111.587 172.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.0 p -159.98 153.89 19.53 Favored Pre-proline 0 N--CA 1.474 0.752 0 C-N-CA 125.559 1.543 . . . . 0.0 111.618 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -77.14 168.83 22.55 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.106 2.537 . . . . 0.0 111.751 170.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -124.4 109.13 12.92 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.489 1.515 . . . . 0.0 109.679 169.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -78.78 147.91 33.13 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -171.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 1.3 m -79.3 -35.91 40.47 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -153.52 163.26 40.26 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.156 1.783 . . . . 0.0 110.738 -176.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.91 -25.22 68.05 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -172.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -63.63 -42.47 98.17 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 118.761 0.709 . . . . 0.0 111.302 173.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.38 -42.88 96.77 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.899 0.88 . . . . 0.0 110.952 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -51.23 64.48 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.634 0.774 . . . . 0.0 111.961 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.57 -41.11 93.94 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.408 0.683 . . . . 0.0 112.404 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.508 HG13 HD11 ' A' ' 132' ' ' LEU . 53.7 mt -58.8 -51.91 66.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 124.679 1.192 . . . . 0.0 111.048 175.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.7 -50.62 71.74 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.16 0.584 . . . . 0.0 110.888 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -61.92 -41.82 98.37 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.909 1.684 . . . . 0.0 112.238 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -59.89 -54.45 46.08 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.434 1.094 . . . . 0.0 111.496 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.95 -19.23 63.38 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.647 -1.283 . . . . 0.0 113.178 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -73.56 -36.26 65.59 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.988 0.915 . . . . 0.0 111.361 169.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -83.24 -39.53 20.77 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.261 0.624 . . . . 0.0 112.34 -173.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.32 -28.92 13.08 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -167.19 23.8 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -172.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.4 ' HB3' HG22 ' A' ' 163' ' ' THR . 56.4 Cg_endo -64.29 126.71 17.56 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 124.091 3.194 . . . . 0.0 114.262 -169.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -140.58 163.01 34.0 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.437 1.495 . . . . 0.0 111.274 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -79.56 161.87 25.7 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.058 -1.651 . . . . 0.0 112.561 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.527 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.48 -33.46 63.7 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.47 0.708 . . . . 0.0 112.249 -179.025 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -64.99 -41.79 95.09 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.023 -0.423 . . . . 0.0 111.289 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 28.4 t -59.45 -45.27 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.16 0.584 . . . . 0.0 109.856 174.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.527 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -62.47 -43.79 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 123.952 0.901 . . . . 0.0 110.43 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.507 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.33 -53.72 54.94 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.615 1.166 . . . . 0.0 110.015 -177.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -63.52 -34.0 76.81 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.2 0.6 . . . . 0.0 112.071 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.96 -25.58 64.62 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.508 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -87.93 -11.91 46.2 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.781 1.632 . . . . 0.0 112.998 169.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.05 11.29 57.75 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.894 1.235 . . . . 0.0 114.26 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 31.5 mtt -81.47 176.88 9.32 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.441 1.896 . . . . 0.0 111.414 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -108.23 -31.91 7.7 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 68.4 p -134.85 155.02 51.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.551 1.14 . . . . 0.0 112.492 -169.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.02 -26.04 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.224 1.009 . . . . 0.0 113.667 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -68.4 -27.64 66.39 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.654 1.182 . . . . 0.0 113.679 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.28 -23.19 62.83 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.044 0.45 . . . . 0.0 111.431 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.507 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -102.05 -31.37 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.212 -0.93 . . . . 0.0 112.666 -177.589 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.62 -40.87 20.64 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.51 1.524 . . . . 0.0 112.539 -173.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -42.38 71.74 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 175.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -78.12 -42.08 33.04 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.83 0.852 . . . . 0.0 112.216 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.5 -52.39 65.41 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.84 0.856 . . . . 0.0 112.398 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -35.01 79.27 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.409 0.684 . . . . 0.0 110.973 179.04 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.2 mtp-105 -60.77 -45.44 94.32 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.411 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.58 -35.63 81.62 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.32 1.048 . . . . 0.0 111.548 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -64.31 -38.52 91.32 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.839 -1.163 . . . . 0.0 113.529 171.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.1 t -69.72 -17.9 63.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 174.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -113.83 15.3 18.67 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.84 38.52 0.93 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.561 1.544 . . . . 0.0 113.613 175.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.47 -32.04 3.92 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.946 1.698 . . . . 0.0 113.343 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -127.35 163.94 22.89 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 119.386 0.993 . . . . 0.0 113.275 175.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -148.34 115.33 6.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.167 2.187 . . . . 0.0 108.988 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.8 ttp -87.97 143.97 26.81 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.493 -0.754 . . . . 0.0 111.679 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.91 124.77 45.58 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 125.15 1.38 . . . . 0.0 110.265 175.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.69 -5.79 40.0 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.21 -0.931 . . . . 0.0 113.03 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -83.51 -33.65 25.49 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.729 1.212 . . . . 0.0 112.731 -176.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.3 t -143.96 10.75 1.56 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.879 1.272 . . . . 0.0 113.336 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.3 mmmt 52.81 36.75 22.2 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.388 2.275 . . . . 0.0 113.439 -169.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.94 119.35 27.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.614 0.766 . . . . 0.0 110.101 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.98 122.53 27.9 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 124.72 1.208 . . . . 0.0 110.857 172.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.4 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.6 OUTLIER -126.14 130.61 51.37 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.145 1.778 . . . . 0.0 108.673 -178.077 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.37 127.81 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 120.747 -1.221 . . . . 0.0 110.506 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -67.99 89.17 0.29 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.922 1.289 . . . . 0.0 111.886 -177.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? . . . . . 0 C--O 1.251 1.174 0 C-N-CA 127.358 2.263 . . . . 0.0 111.297 -179.226 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.2 m . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 34.6 t60 60.42 170.7 0.09 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.941 2.096 . . . . 0.0 114.982 -175.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.6 mtt -71.25 160.36 32.97 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.899 1.679 . . . . 0.0 112.58 178.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.03 6.08 23.44 Favored 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.0 m -129.81 151.06 77.53 Favored Pre-proline 0 N--CA 1.475 0.818 0 C-N-CA 126.407 1.883 . . . . 0.0 111.41 -177.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -76.14 172.23 16.65 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.364 2.709 . . . . 0.0 112.936 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -123.95 119.98 31.16 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.133 1.773 . . . . 0.0 108.945 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -82.01 145.52 30.19 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -169.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 44.6 m -70.53 -34.38 72.21 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.087 0.955 . . . . 0.0 113.139 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -157.05 170.55 22.27 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.763 1.625 . . . . 0.0 110.947 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.64 -24.62 66.84 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 -66.16 -47.14 75.0 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.191 0.905 . . . . 0.0 111.049 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -55.92 -47.92 76.64 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.833 0.742 . . . . 0.0 111.728 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -58.13 -50.56 73.06 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.434 0.693 . . . . 0.0 112.467 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -42.72 99.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.318 176.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.493 HG13 HD11 ' A' ' 132' ' ' LEU . 48.9 mt -56.41 -51.49 63.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 111.148 177.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.7 t80 -65.13 -50.44 66.0 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.593 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -55.51 -49.1 73.48 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.73 1.212 . . . . 0.0 112.157 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -56.18 -53.91 51.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.03 0.932 . . . . 0.0 111.455 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.4 mt -70.77 -19.63 62.69 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 120.802 -1.187 . . . . 0.0 112.944 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.59 -37.4 68.16 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.915 0.78 . . . . 0.0 110.895 169.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -81.22 -39.52 25.25 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.16 -28.22 13.13 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.13 -167.84 25.41 Favored Glycine 0 N--CA 1.471 0.97 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 -171.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -64.55 128.38 21.08 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.761 2.974 . . . . 0.0 114.103 -169.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.9 mm-40 -140.29 162.79 34.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.366 1.466 . . . . 0.0 110.662 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -81.32 161.4 23.87 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 120.159 -1.588 . . . . 0.0 112.008 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.532 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.02 -31.93 63.54 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.052 0.541 . . . . 0.0 112.326 -177.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.2 tp -65.16 -42.0 94.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.948 -0.47 . . . . 0.0 111.219 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.6 t -59.0 -44.99 92.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.055 0.542 . . . . 0.0 109.803 173.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.532 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -63.88 -43.6 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.745 0.818 . . . . 0.0 110.78 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.405 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.08 -54.22 45.93 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.131 1.372 . . . . 0.0 110.153 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -64.17 -34.21 77.56 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.972 0.509 . . . . 0.0 111.964 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.99 -25.92 64.76 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.493 HD11 HG13 ' A' ' 113' ' ' ILE . 2.8 mt -86.68 -11.96 49.75 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.684 1.594 . . . . 0.0 113.134 169.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.37 11.67 60.72 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.708 1.147 . . . . 0.0 113.901 -178.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.0 mmt -85.64 175.69 8.61 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.448 1.899 . . . . 0.0 111.004 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -107.94 -36.58 6.32 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -173.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.7 p -127.12 155.7 42.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.598 1.159 . . . . 0.0 112.403 -171.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.28 -24.64 66.54 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.508 1.123 . . . . 0.0 113.265 175.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -67.4 -28.16 67.68 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.02 1.328 . . . . 0.0 113.402 174.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -71.74 -15.42 62.19 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.268 0.627 . . . . 0.0 112.479 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.413 HG12 HD11 ' A' ' 113' ' ' ILE . 0.1 OUTLIER -113.59 -31.09 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.427 1.091 . . . . 0.0 113.062 -179.731 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.32 -41.99 40.19 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.878 1.271 . . . . 0.0 112.213 -175.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 -55.33 -37.72 67.79 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.44 1.096 . . . . 0.0 113.215 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -81.16 -45.51 16.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.289 1.036 . . . . 0.0 111.558 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.5 mt -58.57 -52.51 65.37 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.327 -178.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.57 -34.48 77.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.036 0.934 . . . . 0.0 111.033 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.7 mtp-105 -64.28 -45.02 89.83 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.279 174.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.96 -35.36 79.9 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.14 0.976 . . . . 0.0 110.801 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -63.4 -40.17 96.5 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.8 -1.188 . . . . 0.0 112.996 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 43.2 m -73.96 -13.82 60.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.568 1.147 . . . . 0.0 114.032 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -113.85 15.42 18.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.753 1.621 . . . . 0.0 115.04 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 72.43 39.05 0.76 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.584 1.554 . . . . 0.0 114.178 175.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -122.82 -31.87 3.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.184 1.794 . . . . 0.0 113.371 -177.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.418 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -128.87 166.24 19.47 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.575 1.08 . . . . 0.0 113.732 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -149.17 119.43 7.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.322 1.849 . . . . 0.0 109.556 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.7 ttp -86.75 144.27 27.15 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.208 -0.932 . . . . 0.0 111.922 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -86.94 130.98 34.23 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.943 1.297 . . . . 0.0 109.813 171.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.06 -10.4 59.73 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 124.637 1.175 . . . . 0.0 112.957 173.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -87.99 -38.53 15.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.409 0.684 . . . . 0.0 112.758 -171.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.6 t -143.74 18.9 1.83 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.176 0.99 . . . . 0.0 113.656 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.78 39.3 28.5 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.303 1.841 . . . . 0.0 113.512 -175.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.6 118.3 25.02 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.935 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -82.92 124.32 30.24 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 110.725 175.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.74 133.13 50.94 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.792 1.637 . . . . 0.0 108.869 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.33 131.61 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.564 1.146 . . . . 0.0 110.743 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -67.87 98.01 0.7 Allowed 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.946 0.879 . . . . 0.0 111.212 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 . . . . . 0 C--O 1.254 1.294 0 C-N-CA 127.215 2.206 . . . . 0.0 112.108 -176.819 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.2 m . . . . . 0 N--CA 1.488 1.458 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -128.73 151.62 49.34 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.359 1.463 . . . . 0.0 111.798 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -104.1 86.86 2.64 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.806 1.242 . . . . 0.0 110.783 -174.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.05 -3.58 49.17 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 36.5 m -161.92 154.26 16.54 Favored Pre-proline 0 N--CA 1.474 0.758 0 C-N-CA 127.815 2.446 . . . . 0.0 110.061 171.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -75.32 173.41 14.55 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.332 2.688 . . . . 0.0 112.525 175.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -123.9 111.78 16.47 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.972 1.709 . . . . 0.0 109.286 171.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -78.62 146.63 34.01 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -169.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.5 t -75.04 -35.5 61.9 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.114 0.965 . . . . 0.0 112.414 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -153.06 171.28 18.64 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.012 1.325 . . . . 0.0 112.351 176.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.47 -32.65 58.13 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.797 1.239 . . . . 0.0 113.234 178.147 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -66.68 -49.72 65.19 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.209 0.913 . . . . 0.0 111.567 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.06 -48.16 70.88 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.138 0.881 . . . . 0.0 111.915 174.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -55.26 -52.1 64.5 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.313 1.045 . . . . 0.0 112.588 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -38.44 85.24 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.377 179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.47 HG13 HD11 ' A' ' 132' ' ' LEU . 44.3 mt -57.33 -50.42 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 119.287 0.949 . . . . 0.0 110.873 178.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -63.84 -51.36 65.02 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.329 0.652 . . . . 0.0 110.694 -178.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -57.95 -43.96 86.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.09 1.356 . . . . 0.0 112.921 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -59.66 -53.69 55.1 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.297 1.039 . . . . 0.0 111.422 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.68 -18.96 62.82 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.827 -1.171 . . . . 0.0 113.04 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -73.48 -36.36 65.8 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.696 0.799 . . . . 0.0 110.891 169.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.64 -38.55 23.37 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.28 0.632 . . . . 0.0 112.378 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.17 -27.7 13.08 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 95.81 -167.7 25.76 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.432 ' HB3' HG22 ' A' ' 163' ' ' THR . 49.7 Cg_endo -63.76 127.76 20.43 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 124.05 3.167 . . . . 0.0 114.228 -169.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -141.3 162.36 35.68 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.401 1.48 . . . . 0.0 111.281 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 -80.57 161.38 24.8 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 120.159 -1.588 . . . . 0.0 112.298 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.539 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.82 -32.33 63.47 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.19 0.596 . . . . 0.0 112.428 -177.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.3 tp -66.38 -39.98 89.42 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.832 -0.543 . . . . 0.0 111.347 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 32.4 t -59.88 -45.7 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 122.927 0.491 . . . . 0.0 109.676 173.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.539 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -63.16 -43.38 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.93 0.892 . . . . 0.0 110.688 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.58 -55.11 35.85 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.203 1.401 . . . . 0.0 110.15 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -64.67 -33.95 77.14 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.939 0.496 . . . . 0.0 111.925 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.85 -26.79 65.33 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 177.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.47 HD11 HG13 ' A' ' 113' ' ' ILE . 3.5 mt -85.96 -12.01 51.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.036 169.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.92 10.6 59.78 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.803 1.192 . . . . 0.0 113.937 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.3 mmt -83.44 176.81 8.8 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.402 1.881 . . . . 0.0 111.109 175.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 88.3 mmt-85 -108.14 -31.06 8.07 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -174.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 66.5 p -135.58 156.56 48.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.337 1.055 . . . . 0.0 112.335 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.17 -25.18 66.84 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.646 1.178 . . . . 0.0 113.371 176.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.04 -27.48 66.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.267 1.427 . . . . 0.0 113.476 174.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.89 -15.33 62.11 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.384 0.673 . . . . 0.0 112.258 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.446 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -114.54 -31.56 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 124.398 1.079 . . . . 0.0 113.061 -179.418 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -48.29 -40.72 25.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.056 1.343 . . . . 0.0 112.729 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -55.82 -44.38 77.86 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.727 1.211 . . . . 0.0 112.683 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.22 -43.02 58.79 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.653 1.181 . . . . 0.0 111.849 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.97 -52.43 65.03 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.124 0.97 . . . . 0.0 112.131 -176.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.11 79.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.304 0.641 . . . . 0.0 110.768 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 -64.3 -42.06 96.54 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 118.523 -0.751 . . . . 0.0 110.857 176.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.33 -34.91 79.22 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.187 0.995 . . . . 0.0 111.411 175.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -64.98 -38.26 90.39 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.791 -1.193 . . . . 0.0 113.232 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.58 -17.49 63.55 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -113.73 15.2 18.8 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.49 38.68 0.98 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.6 1.56 . . . . 0.0 113.824 175.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.8 mp -120.63 -32.67 3.99 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.008 1.723 . . . . 0.0 112.959 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.447 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -129.11 164.29 23.63 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 177.038 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -149.3 115.38 5.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.274 1.83 . . . . 0.0 109.603 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.3 ttp -84.0 145.15 28.67 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 111.802 174.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -91.11 130.36 37.01 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.049 1.339 . . . . 0.0 109.815 171.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.66 -9.22 58.44 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 124.084 0.954 . . . . 0.0 113.05 173.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -87.45 -36.67 17.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.564 0.746 . . . . 0.0 112.865 -172.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.1 t -143.62 18.01 1.84 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.222 1.009 . . . . 0.0 113.551 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 52.39 40.0 28.58 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 126.813 2.045 . . . . 0.0 113.826 -175.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.74 119.74 27.29 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.426 0.691 . . . . 0.0 109.79 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -82.96 125.15 31.07 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.773 1.229 . . . . 0.0 110.953 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.432 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.2 p -130.58 128.29 40.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.234 1.414 . . . . 0.0 108.594 -173.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.62 129.16 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 120.597 -1.315 . . . . 0.0 110.947 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.33 89.25 0.33 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.689 1.195 . . . . 0.0 112.216 -177.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 C--O 1.253 1.239 0 C-N-CA 127.204 2.202 . . . . 0.0 112.012 178.018 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.9 m . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -80.36 152.53 28.86 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.121 0.873 . . . . 0.0 112.181 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -78.48 131.74 36.98 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.328 0.651 . . . . 0.0 110.427 173.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -146.93 171.11 15.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.318 1.447 . . . . 0.0 111.887 -177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 29.0 p -61.57 143.93 93.07 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 123.905 0.882 . . . . 0.0 112.718 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -74.22 177.57 8.09 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 124.068 3.179 . . . . 0.0 113.338 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -118.38 115.74 25.29 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.833 1.653 . . . . 0.0 108.804 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -81.1 148.27 29.71 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -169.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 3.6 m -82.55 -31.2 29.2 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.07 0.948 . . . . 0.0 113.26 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -155.12 166.0 34.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.855 1.662 . . . . 0.0 111.254 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -25.39 65.26 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -176.045 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -72.48 -40.03 67.25 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 118.902 0.774 . . . . 0.0 111.536 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.52 -44.8 89.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.91 0.884 . . . . 0.0 110.058 173.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.16 -55.17 31.33 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.835 0.854 . . . . 0.0 113.081 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -40.53 93.11 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 118.769 0.713 . . . . 0.0 112.324 -177.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.485 HD11 HG12 ' A' ' 140' ' ' VAL . 55.5 mt -61.91 -51.87 67.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 119.426 1.012 . . . . 0.0 111.381 178.411 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -64.02 -48.41 76.47 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.419 0.288 . . . . 0.0 110.782 -177.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -55.57 -50.53 69.82 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.1 1.36 . . . . 0.0 112.382 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.87 -52.04 65.46 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.922 0.889 . . . . 0.0 111.568 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.28 -19.79 63.08 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.92 -1.112 . . . . 0.0 112.931 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -73.3 -37.02 66.36 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.904 0.774 . . . . 0.0 111.185 169.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -80.73 -38.39 28.83 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 -173.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.18 -27.99 12.91 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -168.87 24.85 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -172.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.412 ' HB3' HG22 ' A' ' 163' ' ' THR . 45.6 Cg_endo -62.06 128.35 23.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.033 3.155 . . . . 0.0 113.888 -171.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.5 mm-40 -141.34 163.94 31.58 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.222 1.409 . . . . 0.0 111.189 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 52.2 mtt85 -81.63 159.98 23.87 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 120.322 -1.486 . . . . 0.0 111.928 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.535 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.66 -32.45 63.23 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.221 0.608 . . . . 0.0 112.535 -177.655 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.18 -42.05 94.01 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.792 0.437 . . . . 0.0 111.38 177.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.02 -44.73 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.226 0.61 . . . . 0.0 109.647 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.535 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.432 0.693 . . . . 0.0 110.853 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.478 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.3 -53.97 49.48 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.052 1.341 . . . . 0.0 110.047 -178.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -63.95 -34.07 77.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.223 0.609 . . . . 0.0 112.022 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.82 -24.58 64.4 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.478 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -89.99 -11.94 40.12 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.386 1.474 . . . . 0.0 113.168 169.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.04 10.46 61.16 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 125.007 1.289 . . . . 0.0 113.942 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.5 mmt -82.78 173.57 11.75 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.906 1.682 . . . . 0.0 110.684 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -108.03 -30.65 8.33 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -169.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 67.7 p -135.97 155.98 49.45 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.633 1.173 . . . . 0.0 112.012 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.85 -27.65 65.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.31 -25.56 64.29 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.898 1.279 . . . . 0.0 113.721 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.22 -27.48 66.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.272 0.558 . . . . 0.0 111.113 176.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.485 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.52 -31.18 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 123.62 0.768 . . . . 0.0 112.457 -172.969 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.37 -41.0 12.89 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 112.401 -175.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -54.2 -44.32 71.51 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.732 1.213 . . . . 0.0 113.261 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.27 -42.64 44.88 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.999 0.92 . . . . 0.0 111.568 175.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.17 -52.84 63.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.923 . . . . 0.0 112.255 -177.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -34.03 77.44 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.783 0.833 . . . . 0.0 111.081 176.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.1 mtp85 -58.98 -46.99 86.75 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.39 173.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 41.1 mtm -64.28 -34.65 78.6 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.427 0.691 . . . . 0.0 112.274 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -65.01 -34.34 78.21 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.1 t -75.29 -16.27 60.44 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 173.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -114.04 15.23 18.42 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 6.0 t60 71.54 40.0 0.85 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.494 1.518 . . . . 0.0 114.068 175.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.85 -33.13 3.41 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.249 1.82 . . . . 0.0 113.304 -177.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.7 mt -129.51 163.95 24.81 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.737 1.153 . . . . 0.0 113.575 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -149.06 117.02 6.31 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.208 1.803 . . . . 0.0 109.772 176.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.0 ttp -85.38 143.66 28.49 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.106 0.562 . . . . 0.0 112.088 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.23 123.59 42.39 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 125.909 1.684 . . . . 0.0 109.688 172.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.25 -5.5 36.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.736 0.814 . . . . 0.0 112.876 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -75.84 -36.25 59.7 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.189 1.395 . . . . 0.0 112.355 -178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -148.2 16.45 1.06 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mptt 52.69 40.9 31.13 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.501 1.92 . . . . 0.0 113.004 -170.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -81.88 118.79 23.2 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.663 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -84.22 124.78 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.929 1.291 . . . . 0.0 110.819 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.412 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.5 p -130.47 127.99 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.173 1.389 . . . . 0.0 108.385 -172.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.47 130.48 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 120.606 -1.309 . . . . 0.0 111.077 -179.146 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.84 96.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 122.221 1.01 . . . . 0.0 111.793 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.806 2.443 . . . . 0.0 110.937 -176.362 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.4 m . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -78.95 163.91 24.85 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.463 1.105 . . . . 0.0 113.065 177.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 16.5 tpt -89.05 135.16 33.7 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.351 1.06 . . . . 0.0 111.513 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -146.05 159.01 43.87 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.398 1.479 . . . . 0.0 111.825 177.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 49.7 m 49.37 60.24 15.77 Favored Pre-proline 0 N--CA 1.478 0.942 0 C-N-CA 125.658 1.583 . . . . 0.0 113.952 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -71.41 172.0 15.06 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 124.0 3.133 . . . . 0.0 112.807 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -124.05 109.47 13.54 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.382 1.473 . . . . 0.0 110.557 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -82.14 147.41 29.06 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.233 1.013 . . . . 0.0 112.251 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 64.9 p -77.81 -33.41 52.47 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -153.65 166.37 33.01 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.895 1.278 . . . . 0.0 111.736 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -46.09 -37.67 7.1 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.081 1.752 . . . . 0.0 113.073 175.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -69.21 -41.22 77.37 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.04 0.836 . . . . 0.0 113.238 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -60.84 -45.73 93.32 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.22 0.918 . . . . 0.0 111.108 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.39 -49.5 77.04 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -43.86 95.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.727 0.811 . . . . 0.0 112.381 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.475 HD11 HG12 ' A' ' 140' ' ' VAL . 34.5 mt -58.59 -50.84 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.65 1.18 . . . . 0.0 111.508 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -62.64 -51.49 67.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.945 0.498 . . . . 0.0 111.076 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -61.22 -39.78 91.53 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.436 1.094 . . . . 0.0 112.344 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.48 -54.24 47.91 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.472 1.109 . . . . 0.0 111.482 173.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.46 -18.87 63.76 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.737 -1.227 . . . . 0.0 112.989 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -73.79 -37.15 65.04 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.896 0.878 . . . . 0.0 111.454 169.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.67 -38.89 25.18 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.323 0.649 . . . . 0.0 112.278 -173.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.09 -29.16 11.92 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.76 -167.82 23.37 Favored Glycine 0 N--CA 1.469 0.857 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -172.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.455 ' HB3' HG22 ' A' ' 163' ' ' THR . 56.2 Cg_endo -65.23 128.14 19.82 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.772 2.981 . . . . 0.0 113.814 -170.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -139.06 162.66 34.39 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.585 1.554 . . . . 0.0 111.19 -178.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -79.27 158.16 27.61 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.196 -1.565 . . . . 0.0 111.05 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.541 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.85 -31.72 59.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.262 0.625 . . . . 0.0 112.439 -179.024 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.6 tp -64.86 -41.32 95.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.165 0.586 . . . . 0.0 111.699 177.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.24 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.565 0.746 . . . . 0.0 109.121 174.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.541 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.52 -43.63 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.529 0.732 . . . . 0.0 110.453 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.458 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.19 -55.58 31.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.234 1.414 . . . . 0.0 109.875 -178.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -63.85 -34.63 78.37 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.289 0.636 . . . . 0.0 111.986 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.24 64.28 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.451 HD11 HG13 ' A' ' 113' ' ' ILE . 4.2 mt -89.96 -11.96 40.16 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.488 1.515 . . . . 0.0 113.236 170.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 95.64 5.88 59.87 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.288 1.423 . . . . 0.0 114.248 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 20.4 mmm -80.93 173.77 12.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.557 1.543 . . . . 0.0 110.902 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -106.77 -29.91 9.25 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -170.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.9 p -137.77 156.37 48.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.412 1.085 . . . . 0.0 112.206 -171.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.94 -28.66 64.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.345 1.058 . . . . 0.0 113.833 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.74 -25.1 63.67 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.866 1.266 . . . . 0.0 113.705 176.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.23 -28.5 67.29 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.219 0.533 . . . . 0.0 110.915 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.475 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.01 -31.47 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.531 0.732 . . . . 0.0 112.334 -172.663 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.29 -41.64 6.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.029 1.732 . . . . 0.0 112.872 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -44.84 75.73 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.621 1.168 . . . . 0.0 112.769 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -77.19 -38.7 51.0 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.033 0.933 . . . . 0.0 112.625 175.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.19 -51.4 67.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.768 0.827 . . . . 0.0 112.215 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -33.12 75.29 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.969 -0.457 . . . . 0.0 111.005 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -64.47 -41.22 96.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.355 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.3 mtp -63.86 -37.23 86.64 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.258 0.936 . . . . 0.0 111.997 172.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 120.452 -1.405 . . . . 0.0 112.321 173.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.6 t -67.04 -14.32 62.78 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.231 1.412 . . . . 0.0 114.111 175.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 -113.25 13.23 19.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.547 1.139 . . . . 0.0 114.009 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.6 t60 69.01 39.37 1.79 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.122 1.369 . . . . 0.0 113.087 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -121.71 -34.2 3.45 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.196 1.398 . . . . 0.0 113.478 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.5 mp -119.63 160.35 22.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.799 1.24 . . . . 0.0 112.673 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -144.38 115.38 7.86 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.966 1.706 . . . . 0.0 109.87 174.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.4 ttp -85.83 144.12 27.89 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.298 0.57 . . . . 0.0 111.979 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.15 119.93 40.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.862 1.665 . . . . 0.0 107.999 173.287 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.97 -12.47 60.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.906 0.882 . . . . 0.0 113.286 -172.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -77.52 -35.0 53.84 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.428 1.491 . . . . 0.0 112.68 -170.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.8 t -135.09 11.79 3.58 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.701 1.2 . . . . 0.0 112.797 171.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm 53.44 38.94 29.17 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.128 1.771 . . . . 0.0 112.232 -169.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.82 116.05 19.76 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.344 0.658 . . . . 0.0 109.438 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -81.08 125.37 30.12 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.628 1.171 . . . . 0.0 110.533 171.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.455 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.8 OUTLIER -120.04 163.6 17.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 107.621 176.492 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.94 130.03 36.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 120.817 -1.177 . . . . 0.0 109.467 172.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -68.03 89.62 0.3 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.927 1.291 . . . . 0.0 111.539 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.4 ptt180 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 127.075 2.15 . . . . 0.0 113.004 178.254 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.5 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 120.452 0.168 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -147.06 160.21 42.67 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.692 1.597 . . . . 0.0 112.283 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 93.4 mmm 52.33 41.94 30.76 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.689 1.596 . . . . 0.0 113.985 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.54 161.11 33.37 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.445 1.498 . . . . 0.0 113.154 -174.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 50.4 m -64.08 155.28 79.31 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 125.466 1.506 . . . . 0.0 112.948 177.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.9 171.72 14.1 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.195 2.596 . . . . 0.0 111.957 172.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -124.1 117.69 25.23 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.201 1.4 . . . . 0.0 110.538 174.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -88.44 144.28 26.47 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.064 0.946 . . . . 0.0 111.016 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.9 m -78.48 -27.58 46.31 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.982 0.913 . . . . 0.0 112.925 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -158.41 166.85 31.22 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.712 1.605 . . . . 0.0 110.945 177.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -25.52 68.08 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -173.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -56.06 -47.12 78.53 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 118.774 0.715 . . . . 0.0 111.475 172.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -61.32 -43.14 99.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 122.943 0.497 . . . . 0.0 110.809 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.44 -48.79 80.3 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 122.003 -0.436 . . . . 0.0 112.091 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.565 0.746 . . . . 0.0 112.271 178.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.526 HD11 HG12 ' A' ' 140' ' ' VAL . 25.1 mt -55.89 -51.27 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.985 1.314 . . . . 0.0 111.332 177.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.415 ' CD2' HD12 ' A' ' 152' ' ' LEU . 37.0 t80 -63.49 -51.45 65.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.716 0.406 . . . . 0.0 111.025 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -56.49 -41.63 76.93 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.983 1.313 . . . . 0.0 112.67 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -62.75 -53.26 57.02 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.844 1.258 . . . . 0.0 111.49 175.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.71 -18.71 63.56 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.884 -1.135 . . . . 0.0 112.681 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -73.7 -37.12 65.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 118.938 0.79 . . . . 0.0 111.474 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.96 -38.71 27.24 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.384 0.674 . . . . 0.0 112.319 -173.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -28.69 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.76 -169.23 25.52 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.95 130.24 26.97 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.497 2.798 . . . . 0.0 114.09 -170.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -139.07 163.56 32.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.604 1.562 . . . . 0.0 110.832 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -78.61 157.67 28.65 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 120.21 -1.556 . . . . 0.0 111.106 177.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.504 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -53.26 -33.92 55.09 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.759 0.824 . . . . 0.0 112.524 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.07 -41.26 95.27 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.331 0.652 . . . . 0.0 111.879 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.6 t -59.61 -46.05 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.504 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -60.74 -43.18 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.347 0.659 . . . . 0.0 110.328 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.54 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.5 -54.21 49.44 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.024 -177.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.86 -33.51 76.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.313 0.645 . . . . 0.0 112.119 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.18 -25.13 64.19 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 123.673 0.789 . . . . 0.0 112.962 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.427 HD11 HG13 ' A' ' 113' ' ' ILE . 2.9 mt -89.95 -11.86 40.48 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.678 1.591 . . . . 0.0 113.334 170.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.48 11.48 59.45 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.689 1.138 . . . . 0.0 114.381 -178.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' MET . . . . . 0.425 ' HE3' HD13 ' A' ' 132' ' ' LEU . 33.3 mtt -80.32 176.86 9.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.218 1.807 . . . . 0.0 111.116 171.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 86.0 mtt85 -107.69 -36.8 6.32 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -175.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -132.41 157.01 45.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.459 1.104 . . . . 0.0 112.506 -170.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.45 -27.51 66.14 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.78 1.029 . . . . 0.0 113.78 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -70.58 -23.5 62.6 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.644 1.578 . . . . 0.0 113.986 175.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -71.39 -25.17 62.24 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.276 0.489 . . . . 0.0 111.078 174.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.54 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -102.16 -31.45 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.404 0.682 . . . . 0.0 112.634 -175.723 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.38 -38.58 13.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.553 1.541 . . . . 0.0 113.325 -173.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -47.6 76.86 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.668 1.587 . . . . 0.0 112.441 174.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ASP . . . . . 0.436 ' HB3' HD12 ' A' ' 113' ' ' ILE . 9.2 m-20 -72.72 -41.1 65.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.863 1.265 . . . . 0.0 111.904 176.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.42 -52.14 62.81 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.676 0.79 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.63 -33.67 76.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.844 0.458 . . . . 0.0 110.676 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -67.58 -39.29 84.87 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.03 177.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.74 -37.26 85.89 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 119.704 1.138 . . . . 0.0 111.924 171.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -64.79 -41.17 96.04 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.645 -1.284 . . . . 0.0 112.194 173.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -66.62 -13.99 61.85 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.994 1.318 . . . . 0.0 114.182 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -113.17 13.0 19.18 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.821 1.248 . . . . 0.0 113.972 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.5 t60 69.49 39.32 1.61 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.225 1.41 . . . . 0.0 113.324 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.415 HD12 ' CD2' ' A' ' 114' ' ' TYR . 4.5 mm? -121.47 -34.27 3.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.333 1.453 . . . . 0.0 113.153 -178.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.3 mp -119.9 160.76 22.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.931 1.293 . . . . 0.0 113.11 175.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -142.66 115.55 8.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.348 1.859 . . . . 0.0 110.185 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.2 ttp -88.27 143.66 26.9 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.087 -1.008 . . . . 0.0 112.25 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -89.39 130.81 35.7 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.849 1.26 . . . . 0.0 108.342 169.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.52 -14.11 61.16 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 121.09 -1.006 . . . . 0.0 112.536 175.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -85.35 -37.65 19.66 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -169.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -137.17 13.43 3.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.437 1.095 . . . . 0.0 113.148 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 52.52 42.14 31.25 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.221 1.809 . . . . 0.0 113.035 -176.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.13 117.61 25.98 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.903 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -83.98 120.0 25.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.633 1.173 . . . . 0.0 110.639 173.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.22 165.5 11.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.811 2.044 . . . . 0.0 108.786 170.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.24 127.65 39.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.471 1.108 . . . . 0.0 109.637 170.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -66.15 88.65 0.12 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.392 1.477 . . . . 0.0 112.027 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 45.8 ttm105 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 127.023 2.129 . . . . 0.0 112.037 178.877 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 37.3 m80 62.34 165.67 0.11 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 127.613 2.365 . . . . 0.0 115.287 -175.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 86.2 mmm 55.09 28.21 10.56 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.089 1.756 . . . . 0.0 114.832 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.54 148.07 27.41 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.489 1.116 . . . . 0.0 113.483 -173.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.8 m -86.62 156.54 55.99 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 125.24 1.416 . . . . 0.0 111.936 173.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -68.84 173.95 9.4 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.132 2.555 . . . . 0.0 112.154 169.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -123.7 115.55 21.61 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.891 1.676 . . . . 0.0 108.812 173.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -82.73 147.75 28.27 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -169.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 1.5 m -79.6 -31.75 41.8 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.905 0.882 . . . . 0.0 112.97 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -153.87 164.28 38.64 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.128 1.371 . . . . 0.0 112.452 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -47.94 -42.83 28.35 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.322 1.849 . . . . 0.0 112.945 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 -65.91 -42.05 90.67 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 121.62 -0.675 . . . . 0.0 111.478 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.96 -43.8 86.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.064 1.346 . . . . 0.0 111.045 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -64.92 -50.92 64.59 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.723 0.809 . . . . 0.0 112.385 176.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.45 -40.21 96.52 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.241 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.547 HG13 HD11 ' A' ' 132' ' ' LEU . 51.3 mt -57.91 -51.0 76.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 119.502 1.047 . . . . 0.0 110.992 176.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -63.54 -50.81 68.09 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.758 0.423 . . . . 0.0 110.663 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -58.96 -42.07 88.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.662 1.185 . . . . 0.0 112.963 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.47 -53.56 54.89 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.813 1.245 . . . . 0.0 111.685 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.91 -19.68 64.21 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.987 -1.071 . . . . 0.0 112.618 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -72.99 -37.21 67.08 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.899 0.88 . . . . 0.0 110.892 169.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -76.53 -41.26 47.36 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.947 0.499 . . . . 0.0 112.029 -174.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.12 -28.14 11.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -178.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.36 -168.48 25.53 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 -172.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -62.71 128.58 23.72 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.615 2.877 . . . . 0.0 114.155 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.0 mm-40 -138.96 164.21 30.32 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.132 1.373 . . . . 0.0 110.673 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 63.8 mtt85 -80.56 160.22 25.23 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.36 -1.462 . . . . 0.0 111.347 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.53 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.43 -33.07 63.24 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.278 0.631 . . . . 0.0 112.413 -177.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.3 tp -65.56 -39.79 92.07 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.255 0.622 . . . . 0.0 111.636 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.71 -46.3 96.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 174.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.53 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -61.35 -43.06 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.26 0.624 . . . . 0.0 110.488 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.517 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.9 -54.31 48.4 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.662 1.185 . . . . 0.0 110.145 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.78 -33.63 76.44 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.209 0.604 . . . . 0.0 112.131 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.87 65.37 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.396 0.678 . . . . 0.0 112.789 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.547 HD11 HG13 ' A' ' 113' ' ' ILE . 3.1 mt -88.47 -11.89 44.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.746 1.619 . . . . 0.0 113.394 169.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 11.66 60.18 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 124.704 1.145 . . . . 0.0 114.206 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.0 mtt -79.6 176.95 9.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.23 1.812 . . . . 0.0 111.21 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.99 -35.43 6.62 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 70.2 p -133.13 155.73 48.75 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.699 1.2 . . . . 0.0 112.37 -170.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.3 -27.33 65.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.162 0.985 . . . . 0.0 113.655 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.35 -26.92 65.84 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -68.79 -25.97 64.97 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.044 0.45 . . . . 0.0 111.241 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.517 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -100.68 -31.11 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 121.241 -0.912 . . . . 0.0 112.509 -176.0 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.67 -41.59 22.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.848 1.659 . . . . 0.0 112.216 -174.035 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -54.67 -41.15 69.82 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.567 1.147 . . . . 0.0 113.12 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -78.68 -44.45 23.62 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.559 0.744 . . . . 0.0 111.708 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.28 -52.45 65.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.274 1.029 . . . . 0.0 112.581 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.81 81.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.758 0.823 . . . . 0.0 111.036 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -62.85 -42.01 99.58 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.796 175.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 87.5 mtp -65.77 -34.39 78.07 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.111 0.964 . . . . 0.0 111.091 176.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.9 tttp -65.12 -37.41 87.34 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.998 -1.064 . . . . 0.0 113.399 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -70.05 -18.04 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 174.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -113.75 15.85 18.64 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.44 38.6 1.0 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.487 1.515 . . . . 0.0 113.947 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.39 -32.4 3.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.966 1.707 . . . . 0.0 113.281 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.4 mt -129.08 164.51 23.13 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.491 1.041 . . . . 0.0 113.541 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -147.95 118.55 7.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.711 2.004 . . . . 0.0 109.398 175.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.6 ttp -88.35 143.15 27.19 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.132 -0.98 . . . . 0.0 112.083 173.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -87.22 129.69 34.87 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.95 1.3 . . . . 0.0 109.312 170.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -71.1 -13.0 61.81 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 124.029 0.932 . . . . 0.0 112.432 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 63.6 mm-40 -83.69 -42.6 16.45 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.121 0.968 . . . . 0.0 112.729 -171.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 21.5 t -136.82 15.48 3.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.545 1.138 . . . . 0.0 113.499 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? 52.26 40.99 30.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.553 1.541 . . . . 0.0 112.801 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.15 118.0 24.45 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.637 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -85.03 121.94 28.53 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.713 1.205 . . . . 0.0 111.149 177.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.2 133.34 54.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.994 1.718 . . . . 0.0 109.559 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.81 127.49 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 O-C-N 120.454 -1.404 . . . . 0.0 110.632 176.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.8 92.46 0.22 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.694 1.198 . . . . 0.0 111.937 -177.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.268 1.827 . . . . 0.0 113.826 178.275 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -131.86 158.65 40.78 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.446 1.499 . . . . 0.0 112.251 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.7 mmm -75.28 156.85 35.22 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.159 0.984 . . . . 0.0 111.979 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -136.52 148.66 47.73 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.516 1.126 . . . . 0.0 113.377 -176.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 58.8 p -157.73 158.37 30.35 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.354 2.262 . . . . 0.0 110.231 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -74.18 166.04 30.51 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.405 2.07 . . . . 0.0 111.57 176.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -124.36 112.48 17.0 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.815 1.646 . . . . 0.0 109.437 170.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -67.65 134.02 50.39 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.601 -0.687 . . . . 0.0 110.142 175.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 7.5 m -72.97 -29.35 63.01 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.295 1.038 . . . . 0.0 112.243 -174.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -158.67 168.99 25.39 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.718 2.007 . . . . 0.0 110.689 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -48.04 -35.4 11.06 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.808 1.643 . . . . 0.0 113.337 175.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 24.5 mtm180 -67.47 -39.59 85.3 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.88 -45.1 95.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.544 1.065 . . . . 0.0 111.062 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.36 -47.54 85.64 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.537 0.735 . . . . 0.0 111.469 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.5 -40.7 97.76 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.826 0.85 . . . . 0.0 113.254 177.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.499 HD11 HG12 ' A' ' 140' ' ' VAL . 30.2 mt -60.87 -50.24 81.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 124.359 1.063 . . . . 0.0 111.591 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -61.33 -51.35 69.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.662 0.267 . . . . 0.0 110.79 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -58.98 -42.08 89.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.19 1.396 . . . . 0.0 113.23 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -60.63 -53.68 54.54 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.28 1.032 . . . . 0.0 111.329 174.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.43 -19.6 62.97 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.768 -1.208 . . . . 0.0 112.877 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.95 -38.07 69.85 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.554 1.142 . . . . 0.0 111.043 169.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -82.16 -39.55 23.07 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.322 0.649 . . . . 0.0 112.295 -172.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.94 -28.94 12.1 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.75 -168.19 23.6 Favored Glycine 0 N--CA 1.47 0.946 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -171.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.33 129.12 20.75 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.562 2.841 . . . . 0.0 114.063 -169.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -140.61 161.03 38.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.774 1.629 . . . . 0.0 110.967 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -78.15 161.18 27.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 119.786 -1.822 . . . . 0.0 112.428 176.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.547 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.83 -31.67 62.91 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.259 0.624 . . . . 0.0 112.423 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -41.15 92.48 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.876 -0.515 . . . . 0.0 111.478 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.7 t -59.46 -46.59 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.003 0.521 . . . . 0.0 109.679 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.547 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -61.82 -43.43 97.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.087 0.955 . . . . 0.0 110.232 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.479 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.91 -54.63 44.35 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.904 1.282 . . . . 0.0 110.061 -177.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -64.45 -34.78 79.0 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.161 0.585 . . . . 0.0 112.02 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.29 -25.47 64.26 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.425 HD11 HG13 ' A' ' 113' ' ' ILE . 5.2 mt -89.98 -12.12 39.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.554 1.542 . . . . 0.0 113.36 171.195 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 9.95 62.08 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.757 1.17 . . . . 0.0 114.475 -177.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 18.0 mmt -80.63 176.64 9.62 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.34 1.456 . . . . 0.0 110.632 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -108.09 -31.64 7.86 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -172.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 58.1 p -136.83 156.96 47.81 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.417 1.087 . . . . 0.0 112.234 -171.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -29.89 65.26 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.337 1.055 . . . . 0.0 113.758 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -69.19 -25.12 64.17 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.849 1.26 . . . . 0.0 113.639 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.7 -27.55 66.05 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.193 0.451 . . . . 0.0 110.966 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.499 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.8 -31.14 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.503 0.721 . . . . 0.0 112.565 -173.378 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.65 -41.64 6.84 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.098 1.759 . . . . 0.0 112.591 -176.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -54.73 -44.94 74.0 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.74 1.216 . . . . 0.0 113.106 175.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.7 -41.72 52.87 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.96 0.904 . . . . 0.0 111.846 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.0 mt -60.84 -52.48 64.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.454 1.101 . . . . 0.0 112.493 -177.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -33.1 75.2 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.351 0.661 . . . . 0.0 110.981 178.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -64.45 -42.15 96.14 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.99 176.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.0 mtp -64.47 -35.94 82.58 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.182 0.901 . . . . 0.0 112.136 173.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.18 -41.79 94.28 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.465 -1.397 . . . . 0.0 112.605 173.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.4 t -63.75 -16.15 60.43 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.45 1.1 . . . . 0.0 113.632 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -113.55 15.28 19.01 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 70.83 37.14 1.38 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.393 1.477 . . . . 0.0 113.389 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -121.62 -33.48 3.6 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.124 1.37 . . . . 0.0 113.62 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.8 mp -118.73 161.76 19.58 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.623 1.169 . . . . 0.0 112.53 172.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -144.58 120.49 10.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.441 1.496 . . . . 0.0 110.374 172.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.9 ttp -87.84 144.44 26.59 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.193 -0.942 . . . . 0.0 112.111 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.71 126.17 41.69 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 125.414 1.486 . . . . 0.0 109.977 173.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -74.0 -4.11 33.33 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 124.702 1.201 . . . . 0.0 113.629 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.7 -33.91 15.6 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.552 1.141 . . . . 0.0 112.817 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.5 t -141.26 10.19 2.1 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.855 1.262 . . . . 0.0 113.225 -178.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 51.04 38.12 19.74 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 127.189 2.196 . . . . 0.0 113.584 -169.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.01 117.79 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.995 -176.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.56 121.53 26.43 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.391 1.076 . . . . 0.0 110.459 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.2 164.41 13.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.89 2.076 . . . . 0.0 108.754 171.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.61 126.92 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 124.154 0.982 . . . . 0.0 108.516 169.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -64.0 88.81 0.05 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.576 1.551 . . . . 0.0 112.02 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.269 0 C-N-CA 127.987 2.515 . . . . 0.0 113.203 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.7 m . . . . . 0 N--CA 1.488 1.432 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -76.7 166.62 23.12 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.447 1.099 . . . . 0.0 112.587 176.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -63.16 152.76 36.47 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.9 0.88 . . . . 0.0 113.348 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -88.53 3.42 50.34 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 52.2 m -107.74 148.13 36.74 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.702 1.601 . . . . 0.0 112.309 -177.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -75.68 169.56 22.03 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 123.532 2.821 . . . . 0.0 111.864 172.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -124.44 109.29 13.1 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.354 1.462 . . . . 0.0 111.634 175.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -94.9 147.6 23.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.21 1.004 . . . . 0.0 112.785 174.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 3.4 m -92.58 -32.8 14.67 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.001 1.72 . . . . 0.0 112.935 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -154.69 170.99 20.25 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.931 1.692 . . . . 0.0 111.329 -176.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.04 -31.58 51.87 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.683 1.193 . . . . 0.0 113.3 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -68.47 -50.68 50.6 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.745 1.157 . . . . 0.0 112.074 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -55.11 -46.67 75.59 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.099 0.863 . . . . 0.0 112.122 175.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -55.46 -51.92 65.35 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.344 1.058 . . . . 0.0 113.264 173.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -37.38 83.23 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.232 -0.917 . . . . 0.0 112.504 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.529 HD11 HG12 ' A' ' 140' ' ' VAL . 33.9 mt -56.86 -49.5 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.858 0.863 . . . . 0.0 110.59 178.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -62.83 -52.35 63.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.279 0.632 . . . . 0.0 110.658 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -57.74 -42.87 84.81 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.302 1.441 . . . . 0.0 113.184 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -60.11 -54.44 45.84 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.535 1.134 . . . . 0.0 111.375 173.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.7 mt -71.0 -19.18 62.55 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.668 -1.27 . . . . 0.0 113.079 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -72.55 -37.55 68.24 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.36 1.064 . . . . 0.0 110.803 169.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.21 -39.79 22.62 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.221 0.609 . . . . 0.0 112.312 -172.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.62 -29.15 12.84 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 177.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.25 -169.17 24.83 Favored Glycine 0 N--CA 1.47 0.91 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -171.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -64.24 128.97 22.84 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.007 3.138 . . . . 0.0 114.122 -170.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -140.63 163.41 32.95 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.535 1.534 . . . . 0.0 110.762 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -80.43 161.98 24.66 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.137 -1.602 . . . . 0.0 112.401 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.538 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.9 -32.11 63.46 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.481 0.712 . . . . 0.0 112.545 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.77 -41.72 91.71 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.96 -0.463 . . . . 0.0 111.412 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.47 -45.39 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 122.906 0.482 . . . . 0.0 109.882 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -62.44 -43.53 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.869 0.868 . . . . 0.0 110.468 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.52 -54.68 42.95 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.708 1.203 . . . . 0.0 109.989 -177.253 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.62 0.768 . . . . 0.0 111.971 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.86 -25.75 64.8 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.437 HD11 HG13 ' A' ' 113' ' ' ILE . 3.2 mt -89.45 -11.94 41.59 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.179 1.391 . . . . 0.0 113.192 170.091 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.9 6.73 63.28 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.226 1.393 . . . . 0.0 114.129 -177.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.7 mmt -77.76 172.54 13.27 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.281 1.432 . . . . 0.0 110.292 171.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -108.21 -30.33 8.43 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -135.1 156.75 48.49 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.742 1.217 . . . . 0.0 112.062 -174.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.43 -28.73 67.21 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -66.16 -29.38 69.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.894 1.278 . . . . 0.0 113.702 175.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.53 -26.78 67.31 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.641 0.257 . . . . 0.0 111.14 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.529 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.32 -31.11 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.598 0.759 . . . . 0.0 112.427 -175.72 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.18 -40.75 7.49 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.522 1.529 . . . . 0.0 113.066 -176.017 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -44.69 77.67 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.736 1.214 . . . . 0.0 113.021 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.49 -41.95 59.84 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.286 1.034 . . . . 0.0 111.828 175.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.44 -52.05 66.16 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.695 0.798 . . . . 0.0 112.463 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.75 -32.89 74.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.476 0.71 . . . . 0.0 111.241 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -70.28 -33.49 71.65 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.242 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 94.2 mtp -72.09 -34.29 68.54 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.598 1.159 . . . . 0.0 111.873 170.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 153' ' ' LEU . 25.4 tttp -63.05 -42.09 99.63 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 120.424 -1.423 . . . . 0.0 112.411 172.047 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.5 m -67.17 -14.67 63.13 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -114.13 13.77 18.11 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.84 1.793 . . . . 0.0 115.84 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.48 38.02 0.85 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.44 1.496 . . . . 0.0 113.269 178.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.2 mp -119.8 -32.09 4.34 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.086 1.354 . . . . 0.0 113.275 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.453 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.9 mt -126.94 164.44 21.47 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.128 0.971 . . . . 0.0 113.13 175.115 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -149.37 121.93 8.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.653 1.981 . . . . 0.0 109.197 174.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.5 ttp -90.22 144.73 25.59 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.191 -0.943 . . . . 0.0 112.063 173.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.12 126.01 42.0 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.126 1.37 . . . . 0.0 110.26 174.055 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.25 -6.52 43.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.114 0.966 . . . . 0.0 113.181 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -87.29 -34.78 18.78 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.441 1.096 . . . . 0.0 113.117 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.4 t -141.31 10.4 2.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.827 1.251 . . . . 0.0 113.176 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 51.37 38.87 22.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 127.061 2.145 . . . . 0.0 113.521 -169.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.83 119.1 26.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.374 0.67 . . . . 0.0 109.962 -175.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -83.51 119.96 25.34 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.518 1.127 . . . . 0.0 110.652 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.97 135.13 54.34 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.969 1.707 . . . . 0.0 108.915 175.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -55.38 130.04 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 120.57 -1.331 . . . . 0.0 109.622 169.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -67.37 86.8 0.18 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.959 1.303 . . . . 0.0 112.36 -177.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 60.8 ttp85 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.178 2.991 . . . . 0.0 113.552 -178.344 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -89.7 -63.7 1.25 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.012 0.925 . . . . 0.0 112.541 -176.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 21.1 mmt 50.77 34.81 10.72 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 126.366 1.867 . . . . 0.0 115.549 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.87 153.28 43.5 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.769 0.827 . . . . 0.0 112.906 178.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 44.7 m -67.13 145.61 98.8 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 124.195 0.998 . . . . 0.0 112.519 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -80.46 171.39 14.82 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.542 2.828 . . . . 0.0 112.83 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -124.41 119.69 29.94 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.88 1.672 . . . . 0.0 110.096 169.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -90.8 154.59 19.41 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.1 t -96.15 -31.64 12.88 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.508 1.523 . . . . 0.0 113.214 177.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -144.62 162.43 36.67 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -48.61 -43.35 36.17 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.258 1.823 . . . . 0.0 112.97 178.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 -64.16 -40.5 96.27 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.472 0.578 . . . . 0.0 112.196 -178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.85 -44.81 96.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.068 0.947 . . . . 0.0 111.279 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.53 -46.58 82.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.654 0.781 . . . . 0.0 111.864 174.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.37 -44.95 92.66 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.649 0.78 . . . . 0.0 112.317 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.482 HD11 HG12 ' A' ' 140' ' ' VAL . 49.1 mt -58.65 -50.32 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.537 1.135 . . . . 0.0 111.12 178.091 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -64.77 -50.28 67.44 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.296 0.639 . . . . 0.0 110.821 -178.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -57.33 -45.95 83.77 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.727 1.211 . . . . 0.0 112.245 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -58.12 -53.99 52.02 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.093 0.957 . . . . 0.0 111.433 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.7 mt -70.48 -18.9 62.97 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.82 -1.175 . . . . 0.0 113.193 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -74.35 -36.12 63.59 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.557 0.743 . . . . 0.0 111.415 169.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -82.26 -38.67 24.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.528 0.731 . . . . 0.0 112.234 -173.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -28.62 12.7 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.42 -168.58 24.22 Favored Glycine 0 N--CA 1.469 0.898 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -172.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.444 ' HB3' HG22 ' A' ' 163' ' ' THR . 43.5 Cg_endo -62.49 127.88 22.05 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 124.066 3.177 . . . . 0.0 113.983 -171.129 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -141.28 163.12 33.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.205 1.402 . . . . 0.0 111.144 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 51.6 mtt85 -81.08 160.09 24.56 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.253 -1.529 . . . . 0.0 111.924 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.542 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.03 -31.82 63.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.138 0.575 . . . . 0.0 112.412 -177.669 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.9 tp -64.83 -41.93 95.35 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.946 -0.471 . . . . 0.0 111.401 176.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.68 -45.34 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.096 0.558 . . . . 0.0 109.679 174.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.542 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -62.64 -44.19 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 110.408 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.56 -54.76 40.01 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.105 1.362 . . . . 0.0 110.096 -177.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -64.0 -34.34 77.77 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.381 0.672 . . . . 0.0 112.102 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.17 -25.18 64.23 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 113' ' ' ILE . 2.8 mt -88.94 -12.0 42.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.378 1.471 . . . . 0.0 113.157 169.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.86 11.0 59.47 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.838 1.209 . . . . 0.0 114.119 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.1 mmt -83.43 176.3 9.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.964 1.706 . . . . 0.0 110.817 172.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -105.88 -38.81 6.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -171.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.7 p -130.45 156.37 44.87 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.459 1.103 . . . . 0.0 112.504 -169.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -28.2 63.82 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.42 1.088 . . . . 0.0 113.802 175.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -69.3 -25.37 64.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.889 1.276 . . . . 0.0 113.797 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.29 -27.95 66.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.12 0.486 . . . . 0.0 111.095 176.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.482 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.67 -31.25 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.539 0.736 . . . . 0.0 112.531 -173.109 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.2 -41.45 8.29 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.048 1.739 . . . . 0.0 112.485 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -54.39 -43.55 71.51 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.581 1.152 . . . . 0.0 113.34 175.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.34 -45.32 32.67 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.548 0.739 . . . . 0.0 111.384 175.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.37 -52.04 66.98 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.326 1.05 . . . . 0.0 112.662 -177.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -36.15 82.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.629 0.772 . . . . 0.0 110.779 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -68.09 -37.38 81.14 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.771 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.7 mtp -67.41 -34.65 77.69 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.944 0.898 . . . . 0.0 111.19 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -61.9 -46.04 91.11 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 113.136 171.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 59.9 m -63.74 -16.04 60.11 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 4.5 ptp85 -113.82 16.24 18.48 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 176.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.3 t60 71.42 37.92 1.09 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.863 1.265 . . . . 0.0 113.241 175.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -118.84 -33.4 4.23 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.767 1.627 . . . . 0.0 112.674 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mt -128.31 164.33 22.85 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -150.87 116.51 5.46 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.115 1.766 . . . . 0.0 109.771 176.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 47.2 ttp -85.79 144.57 27.67 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.713 -0.617 . . . . 0.0 111.943 174.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.05 125.83 38.91 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.514 1.526 . . . . 0.0 108.977 170.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.0 -8.15 54.41 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.005 -1.059 . . . . 0.0 112.885 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -84.44 -35.66 22.88 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.866 1.266 . . . . 0.0 112.835 -171.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -139.46 14.25 2.56 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.032 0.933 . . . . 0.0 112.955 172.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt 54.01 41.18 32.13 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 127.156 2.182 . . . . 0.0 113.134 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.17 119.79 25.95 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.558 0.743 . . . . 0.0 109.863 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -83.59 124.61 30.96 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.964 1.306 . . . . 0.0 110.69 173.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.4 p -129.34 127.34 40.88 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.379 1.471 . . . . 0.0 107.8 -174.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.0 130.3 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.58 -1.325 . . . . 0.0 110.451 178.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -67.74 86.83 0.22 Allowed 'General case' 0 CA--C 1.547 0.828 0 CA-C-O 122.657 1.218 . . . . 0.0 112.032 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 . . . . . 0 C--O 1.253 1.285 0 C-N-CA 128.139 2.576 . . . . 0.0 111.85 -175.176 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.0 m . . . . . 0 N--CA 1.488 1.463 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -79.51 155.39 28.26 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.982 0.913 . . . . 0.0 111.948 175.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.5 mmt -104.52 9.66 35.39 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.08 1.352 . . . . 0.0 114.411 -171.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.08 143.99 33.5 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.532 1.133 . . . . 0.0 112.922 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.2 p -155.12 153.58 27.34 Favored Pre-proline 0 N--CA 1.475 0.794 0 C-N-CA 126.098 1.759 . . . . 0.0 110.678 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -78.46 167.94 22.12 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.745 2.297 . . . . 0.0 112.229 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -124.49 109.39 13.2 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.661 1.584 . . . . 0.0 109.746 169.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -75.4 132.84 41.15 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.63 -0.668 . . . . 0.0 110.499 175.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 9.2 t -77.3 -28.16 53.2 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.636 -0.665 . . . . 0.0 112.427 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -147.02 163.55 35.87 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.171 1.388 . . . . 0.0 112.204 177.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -49.01 -34.71 13.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.916 1.686 . . . . 0.0 113.233 177.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -67.36 -40.65 85.78 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -58.62 -49.07 78.85 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.115 0.87 . . . . 0.0 111.01 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.56 -46.43 86.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.005 0.522 . . . . 0.0 112.058 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.4 -42.62 98.79 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.51 HG13 HD11 ' A' ' 132' ' ' LEU . 41.8 mt -58.27 -49.73 80.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 C-N-CA 124.612 1.165 . . . . 0.0 110.814 176.229 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -61.76 -51.66 67.42 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.013 0.925 . . . . 0.0 111.263 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.3 ttp85 -61.27 -42.47 98.7 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.53 1.532 . . . . 0.0 112.377 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.6 -52.11 66.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.701 0.8 . . . . 0.0 111.452 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.439 HD12 HD21 ' A' ' 153' ' ' LEU . 88.4 mt -71.3 -18.43 62.41 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.934 -1.104 . . . . 0.0 112.859 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.46 ' HA ' HD11 ' A' ' 164' ' ' ILE . 12.0 ttmt -69.96 -36.23 75.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.939 0.896 . . . . 0.0 110.386 169.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.28 -39.91 27.9 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -174.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -111.22 -21.04 12.1 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 86.85 -165.5 36.51 Favored Glycine 0 N--CA 1.476 1.34 0 CA-C-O 117.987 -1.451 . . . . 0.0 111.281 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -54.48 120.82 8.67 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.871 3.047 . . . . 0.0 114.531 -171.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -135.41 157.04 47.89 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.473 1.509 . . . . 0.0 110.175 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -76.63 162.21 27.92 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 119.932 -1.73 . . . . 0.0 111.867 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.541 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.84 -30.97 62.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.169 0.588 . . . . 0.0 112.139 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.15 -42.5 93.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.792 -0.568 . . . . 0.0 111.288 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 36.3 t -59.3 -45.7 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.059 0.544 . . . . 0.0 109.669 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.541 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -62.61 -44.14 99.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.859 0.864 . . . . 0.0 110.294 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.43 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -54.99 -54.58 41.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.291 1.436 . . . . 0.0 109.954 -178.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -64.53 -34.33 77.99 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.126 0.571 . . . . 0.0 112.036 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.83 -24.67 64.4 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.638 0.775 . . . . 0.0 113.041 177.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.51 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -90.04 -11.93 40.03 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.66 1.584 . . . . 0.0 113.533 169.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.82 10.82 61.08 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.736 1.16 . . . . 0.0 114.345 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.41 175.78 9.58 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.928 1.691 . . . . 0.0 110.76 172.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -107.74 -34.92 6.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -170.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.2 p -131.95 155.99 46.96 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.541 1.136 . . . . 0.0 112.308 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.04 -28.33 64.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.517 1.127 . . . . 0.0 113.688 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.33 -25.49 64.23 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.878 1.271 . . . . 0.0 113.734 176.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -68.27 -27.43 66.32 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.283 0.492 . . . . 0.0 110.941 177.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.472 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -102.42 -31.22 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 123.592 0.757 . . . . 0.0 112.655 -173.476 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.28 -41.64 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.636 1.575 . . . . 0.0 112.741 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -41.14 69.96 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.803 1.241 . . . . 0.0 113.423 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -79.77 -41.49 26.45 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.2 1.0 . . . . 0.0 112.147 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.07 -52.79 63.42 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.591 0.756 . . . . 0.0 112.226 -178.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -34.19 77.67 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.744 0.818 . . . . 0.0 111.204 178.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 16.1 mtp-105 -60.19 -46.41 89.81 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.636 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.4 ' HB2' HD12 ' A' ' 153' ' ' LEU . 33.9 mtp -66.95 -35.13 79.29 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.057 0.943 . . . . 0.0 111.793 178.134 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -65.33 -38.31 89.74 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.667 -1.27 . . . . 0.0 113.121 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.5 m -72.1 -14.55 61.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.213 1.005 . . . . 0.0 113.574 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -113.92 13.48 18.33 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 178.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 73.26 36.71 0.8 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.882 1.673 . . . . 0.0 114.148 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.7 mp -121.38 -32.08 3.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.069 1.348 . . . . 0.0 113.668 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.461 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.7 mt -124.34 164.01 20.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.453 1.101 . . . . 0.0 113.036 173.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -148.42 115.42 6.1 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.348 1.859 . . . . 0.0 108.82 179.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.5 ttp -87.67 141.41 28.63 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.379 -0.826 . . . . 0.0 111.587 172.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.84 126.68 37.02 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 124.713 1.205 . . . . 0.0 110.066 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -71.48 -7.12 45.42 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 124.273 1.029 . . . . 0.0 113.19 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -90.22 -33.88 16.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.595 1.158 . . . . 0.0 112.882 -173.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.2 t -142.0 11.26 1.99 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.99 1.316 . . . . 0.0 113.127 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 51.29 37.77 19.64 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 127.361 2.264 . . . . 0.0 114.106 -171.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -89.59 116.88 28.06 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.602 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -79.2 122.34 26.16 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.044 1.337 . . . . 0.0 111.294 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.4 t -132.18 144.43 50.66 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.809 1.643 . . . . 0.0 112.914 171.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' ILE . . . . . 0.46 HD11 ' HA ' ' A' ' 118' ' ' LYS . 0.4 OUTLIER -55.73 125.79 11.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 126.088 1.755 . . . . 0.0 111.29 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -65.1 89.42 0.08 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.503 1.521 . . . . 0.0 112.829 -177.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 77.0 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 128.301 2.64 . . . . 0.0 112.279 171.346 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -73.24 -32.53 64.78 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.843 0.857 . . . . 0.0 113.208 -178.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.8 ptp -145.67 161.45 39.85 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.395 1.478 . . . . 0.0 112.192 175.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.97 162.77 24.73 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.289 1.036 . . . . 0.0 112.755 174.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 22.2 m 65.29 153.7 0.12 Allowed Pre-proline 0 N--CA 1.483 1.201 0 C-N-CA 127.227 2.211 . . . . 0.0 115.294 -178.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -73.64 171.64 17.39 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.313 2.675 . . . . 0.0 112.243 174.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -124.24 116.84 23.33 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.497 1.519 . . . . 0.0 111.264 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -98.37 144.15 28.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.487 1.115 . . . . 0.0 112.551 174.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 1.5 m -94.19 -29.89 14.89 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.887 1.675 . . . . 0.0 112.723 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -153.52 167.37 29.71 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.907 1.683 . . . . 0.0 111.421 -175.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -33.29 53.96 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.819 1.247 . . . . 0.0 113.237 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -68.8 -45.48 71.16 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.517 1.053 . . . . 0.0 112.307 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.9 -42.99 90.88 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 110.882 177.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.11 -50.92 68.61 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.415 1.086 . . . . 0.0 112.552 175.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -38.34 90.24 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.619 -0.705 . . . . 0.0 112.525 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.507 HD11 HG12 ' A' ' 140' ' ' VAL . 44.1 mt -58.69 -50.75 78.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 119.248 0.931 . . . . 0.0 110.746 176.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.36 -51.65 66.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.987 0.115 . . . . 0.0 110.749 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -57.38 -43.92 84.01 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.184 1.394 . . . . 0.0 113.07 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -59.16 -54.08 51.06 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.194 0.998 . . . . 0.0 111.286 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -70.93 -19.43 62.58 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.744 -1.222 . . . . 0.0 113.087 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -73.14 -36.89 66.75 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.075 0.95 . . . . 0.0 111.117 169.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -82.42 -39.14 23.03 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.339 0.656 . . . . 0.0 112.27 -172.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.14 -28.1 12.87 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 177.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.71 -168.62 25.14 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.415 ' HB3' HG22 ' A' ' 163' ' ' THR . 41.8 Cg_endo -62.41 128.49 23.83 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.993 3.129 . . . . 0.0 114.006 -170.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -139.74 164.25 30.45 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.14 1.376 . . . . 0.0 111.09 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.4 mtt-85 -78.86 157.53 28.31 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 120.432 -1.418 . . . . 0.0 111.119 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.538 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -53.81 -32.76 53.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.597 0.759 . . . . 0.0 112.542 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.1 tp -64.9 -41.05 95.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.245 0.618 . . . . 0.0 111.684 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 31.6 t -60.66 -45.43 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -61.1 -44.07 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.428 0.691 . . . . 0.0 110.459 178.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.469 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.21 -54.98 38.79 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.131 1.372 . . . . 0.0 110.161 -177.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -64.27 -34.3 77.8 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.275 0.63 . . . . 0.0 111.959 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.71 -24.82 64.53 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.459 HD11 HG13 ' A' ' 113' ' ' ILE . 3.0 mt -90.51 -12.02 38.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.087 1.355 . . . . 0.0 113.301 170.126 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.55 11.65 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.129 1.347 . . . . 0.0 114.371 -178.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.3 mmt -84.0 176.13 9.06 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.036 1.734 . . . . 0.0 110.99 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -107.49 -35.64 6.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -171.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.9 p -133.34 157.22 46.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.608 1.163 . . . . 0.0 112.05 -171.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.15 -28.22 66.38 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 176.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.75 -28.95 68.82 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.741 1.216 . . . . 0.0 113.765 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.92 -28.36 68.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.949 0.404 . . . . 0.0 111.116 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.507 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -100.34 -31.19 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.706 0.802 . . . . 0.0 112.239 -174.403 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.07 -41.22 7.46 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.733 1.613 . . . . 0.0 112.617 -175.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -55.48 -42.86 74.96 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.63 1.172 . . . . 0.0 113.465 176.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -77.24 -43.46 33.42 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.072 0.949 . . . . 0.0 111.562 174.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.6 mt -59.08 -51.92 67.98 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.073 0.949 . . . . 0.0 112.433 -177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -34.71 78.29 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.327 0.651 . . . . 0.0 111.256 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.1 mtt-85 -64.24 -38.77 92.24 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.075 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 91.1 mtp -67.65 -35.49 78.98 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.155 0.982 . . . . 0.0 111.997 174.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -63.3 -38.62 91.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.787 -1.196 . . . . 0.0 113.132 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.3 t -68.96 -18.17 64.04 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -113.84 15.89 18.53 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.812 1.782 . . . . 0.0 115.812 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 72.02 38.43 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.328 1.451 . . . . 0.0 113.395 175.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -120.66 -32.83 3.94 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.978 1.711 . . . . 0.0 113.081 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -128.02 163.7 23.98 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.5 1.045 . . . . 0.0 113.781 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -147.69 115.45 6.4 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.959 2.103 . . . . 0.0 108.969 178.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.9 ttp -88.47 143.87 26.71 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.687 -0.633 . . . . 0.0 111.757 174.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -89.68 130.6 35.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.74 1.216 . . . . 0.0 109.619 170.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.97 -7.57 54.92 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.975 0.91 . . . . 0.0 113.016 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -88.72 -34.16 17.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.33 0.652 . . . . 0.0 112.548 -173.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.21 13.13 1.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.47 1.108 . . . . 0.0 113.78 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt 53.07 38.98 28.77 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 126.227 1.811 . . . . 0.0 113.265 -174.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.65 118.37 23.8 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.589 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -85.2 122.67 29.72 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.456 1.103 . . . . 0.0 110.866 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.415 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -127.24 129.44 47.78 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.752 1.621 . . . . 0.0 108.555 -176.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.74 128.86 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 110.813 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -68.27 90.56 0.35 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.792 1.237 . . . . 0.0 112.031 -177.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? . . . . . 0 C--O 1.253 1.286 0 C-N-CA 127.539 2.336 . . . . 0.0 111.346 176.986 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 61.4 p . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 120.761 0.315 . . . . 0.0 111.745 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -141.95 152.3 43.37 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.2 1.4 . . . . 0.0 111.922 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 48.5 ttp -145.04 153.95 42.0 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.645 1.578 . . . . 0.0 110.627 176.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.09 4.56 6.57 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -172.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.6 p -70.0 141.65 89.61 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 124.718 1.207 . . . . 0.0 111.849 171.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -78.94 169.43 19.41 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.02 2.48 . . . . 0.0 112.932 -177.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -124.01 110.1 14.36 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.824 2.049 . . . . 0.0 108.526 170.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -76.98 143.84 39.16 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -169.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.0 t -78.29 -32.49 49.45 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.351 1.06 . . . . 0.0 112.733 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -151.54 164.63 36.41 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.633 1.173 . . . . 0.0 112.845 177.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -49.15 -39.06 27.5 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.89 1.676 . . . . 0.0 113.178 177.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 -68.12 -39.76 82.69 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.816 0.735 . . . . 0.0 112.289 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.79 -44.8 93.77 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.164 0.986 . . . . 0.0 110.585 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.88 -49.55 74.41 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.266 1.026 . . . . 0.0 112.45 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.63 -41.35 98.96 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.693 0.797 . . . . 0.0 113.028 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.477 HD11 HG12 ' A' ' 140' ' ' VAL . 45.6 mt -60.56 -49.55 83.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 124.231 1.012 . . . . 0.0 110.653 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.88 -50.67 69.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.668 0.387 . . . . 0.0 111.098 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -58.17 -44.46 88.0 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.351 1.46 . . . . 0.0 112.807 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -59.06 -53.34 59.46 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.951 0.9 . . . . 0.0 111.385 174.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.9 -18.69 62.66 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.773 -1.204 . . . . 0.0 113.104 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.4 ttmt -73.26 -36.0 66.29 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.69 0.796 . . . . 0.0 110.76 169.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.76 -38.34 21.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.403 0.681 . . . . 0.0 112.318 -171.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.93 -26.62 13.36 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 176.608 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.87 -167.25 26.68 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -172.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.433 ' HB3' HG22 ' A' ' 163' ' ' THR . 53.1 Cg_endo -63.86 128.2 21.43 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.943 3.095 . . . . 0.0 113.936 -170.1 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.6 mm-40 -139.52 164.65 29.34 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.27 1.428 . . . . 0.0 111.385 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -79.25 157.79 27.71 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.364 -1.46 . . . . 0.0 111.082 177.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.32 -32.74 57.36 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.456 0.702 . . . . 0.0 112.567 -179.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.0 tp -65.98 -39.65 90.53 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.197 0.599 . . . . 0.0 111.887 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 29.6 t -60.9 -45.06 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.531 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -61.6 -44.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.349 0.66 . . . . 0.0 110.639 178.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.448 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.71 -54.92 38.34 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 125.028 1.331 . . . . 0.0 110.028 -177.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.55 -33.41 75.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.216 0.606 . . . . 0.0 112.067 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.05 -25.16 64.32 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.465 HD11 HG13 ' A' ' 113' ' ' ILE . 2.4 mt -89.5 -12.06 41.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.209 1.404 . . . . 0.0 113.097 169.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.9 9.25 59.85 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 125.174 1.369 . . . . 0.0 114.276 -177.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.7 mmt -83.37 172.72 12.21 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.035 1.734 . . . . 0.0 111.06 174.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -107.96 -28.96 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -169.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.5 p -132.15 152.71 51.12 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.952 1.301 . . . . 0.0 111.739 -171.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.2 -29.77 65.94 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.99 0.916 . . . . 0.0 112.614 171.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -67.54 -23.69 65.46 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 127.231 2.213 . . . . 0.0 114.696 174.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -70.35 -28.65 65.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.792 0.724 . . . . 0.0 110.879 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.477 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -100.79 -31.51 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.276 0.63 . . . . 0.0 112.336 -171.977 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.42 -40.75 5.71 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.027 1.731 . . . . 0.0 113.021 -176.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -45.5 77.2 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.579 1.152 . . . . 0.0 112.852 175.701 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.98 -40.95 60.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.231 1.012 . . . . 0.0 112.012 174.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.0 -52.8 62.54 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.557 0.743 . . . . 0.0 112.173 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.04 -34.62 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.68 -0.637 . . . . 0.0 111.343 177.043 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -57.91 -48.06 81.0 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.45 0.3 . . . . 0.0 110.261 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -64.08 -35.6 81.28 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 124.325 1.05 . . . . 0.0 111.515 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -64.75 -37.12 86.54 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.983 -1.073 . . . . 0.0 113.689 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.1 t -71.55 -18.13 62.27 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -113.73 15.4 18.76 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.408 1.632 . . . . 0.0 115.408 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.64 39.27 0.89 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.502 1.521 . . . . 0.0 113.981 175.133 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.16 -32.63 3.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.177 1.791 . . . . 0.0 113.099 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.401 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -128.53 163.81 24.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.641 1.11 . . . . 0.0 113.665 176.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -148.79 115.24 5.89 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.795 2.038 . . . . 0.0 108.959 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -89.62 140.9 29.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.649 0.738 . . . . 0.0 111.76 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -102.05 107.0 17.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 126.259 1.823 . . . . 0.0 107.382 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.4 -8.88 20.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.089 1.356 . . . . 0.0 112.868 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -66.09 -32.83 74.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.68 1.992 . . . . 0.0 112.283 177.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.13 16.7 0.84 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 173.042 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.1 mptt 50.22 39.93 20.96 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.345 2.258 . . . . 0.0 113.384 -170.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.84 118.27 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.383 0.673 . . . . 0.0 109.866 174.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -83.4 127.05 33.37 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.333 1.453 . . . . 0.0 111.428 173.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.0 OUTLIER -132.81 129.54 38.66 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.859 1.664 . . . . 0.0 108.494 -174.581 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.39 129.52 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.497 -1.377 . . . . 0.0 111.301 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.1 88.01 0.41 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.046 1.338 . . . . 0.0 112.187 -177.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.845 2.058 . . . . 0.0 113.519 176.455 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.4 m . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -129.28 160.08 34.12 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.462 1.505 . . . . 0.0 111.995 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 15.7 tpt -68.36 138.19 55.2 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.842 0.857 . . . . 0.0 111.744 177.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.44 150.62 25.93 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.327 1.051 . . . . 0.0 112.908 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 60.4 p 63.07 146.89 0.09 OUTLIER Pre-proline 0 N--CA 1.481 1.117 0 C-N-CA 128.639 2.775 . . . . 0.0 116.512 -177.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -81.04 173.46 11.88 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 124.169 3.246 . . . . 0.0 112.572 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -124.28 109.27 13.16 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.14 1.376 . . . . 0.0 111.84 172.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -90.11 144.7 25.65 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.243 1.017 . . . . 0.0 112.099 175.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 6.4 m -92.52 -23.95 18.93 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.65 1.18 . . . . 0.0 114.105 173.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -153.24 167.48 29.18 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.9 0.88 . . . . 0.0 113.287 178.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -46.66 -42.72 16.82 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.997 1.719 . . . . 0.0 113.005 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 -62.86 -45.4 92.74 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.73 0.695 . . . . 0.0 112.599 -179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -62.32 -45.78 91.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.291 0.567 . . . . 0.0 111.521 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.22 -48.93 75.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.718 0.807 . . . . 0.0 112.459 171.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.8 -46.21 88.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.005 0.922 . . . . 0.0 112.384 175.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.456 HD11 HG12 ' A' ' 140' ' ' VAL . 39.9 mt -57.73 -50.09 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 124.585 1.154 . . . . 0.0 110.948 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -65.09 -50.99 63.98 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.026 0.531 . . . . 0.0 110.893 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -56.7 -45.56 81.75 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.522 1.129 . . . . 0.0 111.968 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -58.44 -54.3 48.55 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.138 0.975 . . . . 0.0 111.434 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.4 mt -70.53 -18.9 62.94 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.861 -1.149 . . . . 0.0 113.359 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -74.34 -36.33 63.64 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.829 0.74 . . . . 0.0 111.423 169.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -81.77 -38.63 25.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.418 0.687 . . . . 0.0 112.322 -173.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.98 -29.03 12.78 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.66 -168.85 24.1 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -171.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.416 ' HB3' HG22 ' A' ' 163' ' ' THR . 48.7 Cg_endo -63.22 127.81 21.09 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.166 3.244 . . . . 0.0 114.126 -171.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -141.41 162.68 34.89 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.234 1.414 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -79.32 161.38 26.29 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 120.153 -1.592 . . . . 0.0 112.503 178.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.542 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.05 -32.39 64.01 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.244 0.618 . . . . 0.0 112.413 -179.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.6 tp -65.09 -41.58 94.88 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.789 -0.569 . . . . 0.0 111.365 177.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.5 t -59.34 -45.06 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.971 0.508 . . . . 0.0 109.896 174.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.542 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -63.73 -43.0 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.758 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.437 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.85 -54.78 40.33 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.13 1.372 . . . . 0.0 110.06 -178.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -63.93 -34.55 78.22 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.251 0.62 . . . . 0.0 111.939 -179.382 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.46 64.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 177.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.452 HD11 HG13 ' A' ' 113' ' ' ILE . 3.6 mt -88.48 -11.88 44.6 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.567 1.547 . . . . 0.0 113.256 170.005 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.99 10.86 60.81 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.697 1.141 . . . . 0.0 114.144 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.0 mmt -83.47 175.32 9.89 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.988 1.715 . . . . 0.0 110.859 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -107.8 -34.62 6.9 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -171.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 63.0 p -132.45 156.78 46.12 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.584 1.154 . . . . 0.0 112.181 -171.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.17 66.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 113.732 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.95 -29.73 69.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.913 1.285 . . . . 0.0 113.773 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -67.2 -23.97 65.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.861 0.362 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.456 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.77 -30.93 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.98 0.912 . . . . 0.0 112.598 -176.235 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.89 -40.62 14.4 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.326 1.45 . . . . 0.0 112.747 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -44.34 77.94 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.495 1.118 . . . . 0.0 112.744 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.64 -42.8 60.92 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.807 1.243 . . . . 0.0 111.814 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.2 mt -62.44 -51.52 67.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.981 0.913 . . . . 0.0 112.306 -176.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.68 -34.56 78.13 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.27 0.628 . . . . 0.0 110.792 178.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 83.1 mtt-85 -65.64 -37.26 86.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.492 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.7 mtp -68.83 -34.05 74.85 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.066 0.946 . . . . 0.0 111.874 173.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.5 tttp -64.09 -38.66 91.86 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.581 -1.324 . . . . 0.0 112.803 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.95 -14.61 62.79 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 175.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -114.08 14.83 18.39 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 175.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 72.06 38.51 0.89 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.363 1.465 . . . . 0.0 113.417 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -120.39 -32.86 4.0 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.767 1.627 . . . . 0.0 113.19 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.446 HD11 ' CG2' ' A' ' 113' ' ' ILE . 10.9 mt -128.08 163.44 24.6 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 176.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -150.23 115.37 5.39 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.165 1.786 . . . . 0.0 109.788 177.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 48.9 ttp -84.09 145.97 28.16 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.802 -0.561 . . . . 0.0 111.8 174.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -96.15 127.47 42.19 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 125.239 1.415 . . . . 0.0 109.135 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -71.14 -13.83 62.08 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.178 -0.951 . . . . 0.0 112.377 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -83.82 -37.34 22.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.678 1.191 . . . . 0.0 113.251 -169.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 6.3 t -134.16 8.11 3.71 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.196 1.398 . . . . 0.0 112.629 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm 51.53 40.18 26.38 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 127.053 2.141 . . . . 0.0 113.328 -170.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.31 120.38 28.54 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.612 -177.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -82.09 124.81 30.17 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.528 1.131 . . . . 0.0 110.801 172.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.416 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.5 p -130.36 128.0 40.54 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 108.465 -173.312 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.37 128.62 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 120.466 -1.397 . . . . 0.0 110.9 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -67.43 90.35 0.24 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.797 1.239 . . . . 0.0 111.89 -178.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 126.853 2.061 . . . . 0.0 112.475 179.012 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 41.7 m . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -74.89 -35.31 62.28 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.742 0.817 . . . . 0.0 113.009 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 14.3 tpt -142.38 126.16 17.05 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.135 1.374 . . . . 0.0 111.078 177.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 58.13 166.58 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 127.757 2.423 . . . . 0.0 116.867 178.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.503 ' H ' ' HD2' ' A' ' 103' ' ' PRO . 65.3 m -107.18 -51.95 0.09 OUTLIER Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 125.766 1.627 . . . . 0.0 112.446 170.569 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.503 ' HD2' ' H ' ' A' ' 102' ' ' SER . 69.2 Cg_endo -73.0 176.21 9.4 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.981 2.454 . . . . 0.0 111.747 169.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -123.95 109.06 13.08 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.496 1.118 . . . . 0.0 111.556 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -94.9 140.2 30.27 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.532 1.133 . . . . 0.0 111.549 173.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.8 m -86.27 -24.64 25.88 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 174.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -153.73 167.43 29.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.064 0.946 . . . . 0.0 113.046 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -47.47 -42.4 22.68 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.929 1.692 . . . . 0.0 113.012 177.179 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -61.64 -46.25 90.58 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 118.684 0.674 . . . . 0.0 112.418 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -62.28 -45.69 92.13 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.708 0.803 . . . . 0.0 111.39 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.41 -48.55 76.71 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.912 0.885 . . . . 0.0 112.971 170.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.46 -44.41 95.89 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.061 0.944 . . . . 0.0 112.595 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.53 HD11 HG12 ' A' ' 140' ' ' VAL . 32.9 mt -57.97 -49.52 80.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 124.751 1.22 . . . . 0.0 110.799 178.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -64.28 -50.05 69.43 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.071 0.548 . . . . 0.0 110.711 -177.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -54.58 -51.42 65.34 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.188 0.995 . . . . 0.0 111.971 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -54.56 -52.0 63.45 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 123.851 0.86 . . . . 0.0 111.538 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.32 -19.89 61.58 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.943 -1.098 . . . . 0.0 113.004 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -73.05 -34.27 66.18 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.846 0.858 . . . . 0.0 110.704 169.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.63 -39.0 20.82 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.972 0.909 . . . . 0.0 111.706 -170.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.93 -27.93 11.87 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 176.001 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 98.49 -169.81 23.88 Favored Glycine 0 N--CA 1.474 1.186 0 CA-C-O 118.785 -1.008 . . . . 0.0 110.644 -171.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.4 ' HB3' HG22 ' A' ' 163' ' ' THR . 35.6 Cg_endo -61.5 129.53 28.42 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.985 3.124 . . . . 0.0 114.122 -171.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -139.76 164.82 28.94 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.304 1.442 . . . . 0.0 110.785 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.12 158.29 26.42 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.33 -1.481 . . . . 0.0 111.068 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.53 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.13 -33.2 57.23 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.445 0.698 . . . . 0.0 112.605 -178.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.88 -39.93 91.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.178 0.591 . . . . 0.0 111.848 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.0 t -60.31 -45.91 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.53 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -61.05 -43.4 96.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.364 0.665 . . . . 0.0 110.528 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.523 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.42 -54.33 48.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.636 1.175 . . . . 0.0 110.077 -177.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -65.28 -33.16 75.32 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.987 0.515 . . . . 0.0 112.061 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.93 -25.71 64.71 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.479 HD11 HG13 ' A' ' 113' ' ' ILE . 3.0 mt -88.6 -11.27 45.97 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.249 1.419 . . . . 0.0 113.319 169.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.84 11.54 61.65 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.762 1.172 . . . . 0.0 114.236 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.2 mtt -80.52 176.21 9.99 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.007 1.723 . . . . 0.0 111.211 171.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -108.14 -35.96 6.43 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.4 p -125.64 152.2 45.5 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.024 1.33 . . . . 0.0 112.312 -170.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.12 -29.09 68.39 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -64.13 -28.58 69.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.935 2.094 . . . . 0.0 114.453 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -72.26 -20.62 61.5 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.822 0.737 . . . . 0.0 111.439 177.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.53 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.48 -30.57 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.539 -0.725 . . . . 0.0 112.651 -177.157 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.07 -40.28 31.06 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.379 1.472 . . . . 0.0 112.389 -173.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -52.38 -50.17 62.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.682 1.193 . . . . 0.0 111.817 173.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -71.15 -41.76 70.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.009 1.324 . . . . 0.0 111.654 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.03 -52.9 61.06 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.109 0.963 . . . . 0.0 111.916 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -33.04 74.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.776 0.83 . . . . 0.0 111.302 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 48.0 mtp85 -61.52 -43.07 99.53 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.923 174.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.1 mtp -69.71 -33.18 72.15 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.997 0.919 . . . . 0.0 111.809 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -62.8 -42.23 99.62 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.488 -1.382 . . . . 0.0 112.408 170.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.9 m -69.18 -13.85 62.65 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 178.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -114.08 14.89 18.39 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 72.77 38.46 0.75 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.361 1.464 . . . . 0.0 113.588 176.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.1 mp -121.51 -31.9 3.94 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.731 1.612 . . . . 0.0 113.368 -178.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.445 HD11 ' CG2' ' A' ' 113' ' ' ILE . 10.0 mt -127.35 164.19 22.34 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -148.38 115.84 6.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.809 1.643 . . . . 0.0 110.259 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -86.15 144.27 27.58 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.343 -0.848 . . . . 0.0 112.034 174.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.37 130.61 34.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.71 1.204 . . . . 0.0 109.236 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -73.82 -9.34 58.55 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 124.679 1.192 . . . . 0.0 112.878 176.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -90.79 -39.1 12.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -174.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.64 15.12 2.34 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.72 40.84 31.11 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 126.162 1.785 . . . . 0.0 113.045 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.42 117.35 23.58 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.47 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.52 122.32 28.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.197 0.999 . . . . 0.0 110.637 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.4 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.2 OUTLIER -126.46 131.17 51.72 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 125.513 1.525 . . . . 0.0 108.434 -178.438 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -52.23 133.33 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.115 -0.991 . . . . 0.0 110.702 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -70.26 102.12 2.05 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 111.193 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.707 2.003 . . . . 0.0 112.758 173.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.554 0.216 . . . . 0.0 111.474 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -72.69 149.7 43.58 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.698 1.199 . . . . 0.0 112.639 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.65 11.83 31.9 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -174.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -140.14 161.83 36.69 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.514 1.525 . . . . 0.0 112.227 175.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.509 ' H ' ' HD2' ' A' ' 103' ' ' PRO . 31.8 t -121.65 -53.12 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 125.116 1.366 . . . . 0.0 114.292 -177.147 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.509 ' HD2' ' H ' ' A' ' 102' ' ' SER . 61.2 Cg_endo -74.44 172.95 15.1 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 122.335 2.023 . . . . 0.0 112.617 175.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -123.84 117.52 25.05 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.737 1.615 . . . . 0.0 110.339 174.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -90.71 143.15 27.02 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.813 0.845 . . . . 0.0 112.833 -176.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 6.5 t -86.31 -25.72 25.29 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.044 1.338 . . . . 0.0 112.891 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -149.69 165.15 33.22 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.877 1.271 . . . . 0.0 112.296 176.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.28 -33.05 62.89 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.851 1.26 . . . . 0.0 113.091 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 -65.29 -49.92 67.7 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.03 0.832 . . . . 0.0 111.7 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -53.87 -48.65 69.82 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.873 0.76 . . . . 0.0 112.061 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.56 -51.25 70.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.018 0.927 . . . . 0.0 112.155 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.09 -42.33 99.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 118.589 -0.72 . . . . 0.0 112.262 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.475 HD11 HG12 ' A' ' 140' ' ' VAL . 49.5 mt -57.75 -51.31 71.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.66 1.118 . . . . 0.0 111.256 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -65.26 -49.3 70.14 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.124 0.57 . . . . 0.0 110.423 -176.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.7 tpt85 -58.59 -43.86 89.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.559 1.144 . . . . 0.0 112.825 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -60.75 -53.85 52.33 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 124.756 1.222 . . . . 0.0 111.558 175.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.21 -19.54 63.96 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.957 -1.089 . . . . 0.0 112.705 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -73.84 -35.48 64.82 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.729 0.695 . . . . 0.0 111.482 169.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -77.72 -41.37 38.09 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.158 0.583 . . . . 0.0 111.957 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.58 -28.01 11.99 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -178.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.29 -166.7 24.51 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -172.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.453 ' HB3' HG22 ' A' ' 163' ' ' THR . 47.8 Cg_endo -62.97 125.91 16.91 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.896 3.064 . . . . 0.0 114.124 -169.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -139.13 162.24 35.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.205 1.402 . . . . 0.0 110.973 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -81.12 160.25 24.48 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.282 -1.511 . . . . 0.0 112.032 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.2 -32.8 62.51 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.6 0.636 . . . . 0.0 112.522 -177.227 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.7 tp -65.74 -40.87 92.59 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.957 -0.464 . . . . 0.0 111.493 177.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.1 t -59.14 -46.35 92.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.169 0.587 . . . . 0.0 109.638 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.531 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -62.26 -43.36 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.834 0.853 . . . . 0.0 110.547 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.492 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -58.06 -53.88 53.23 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.504 1.121 . . . . 0.0 110.185 -178.148 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.04 -34.31 77.73 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.072 0.549 . . . . 0.0 111.984 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.91 -26.33 65.93 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.422 0.689 . . . . 0.0 112.833 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.467 HD11 HG13 ' A' ' 113' ' ' ILE . 4.1 mt -86.35 -11.94 50.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.658 1.583 . . . . 0.0 113.19 169.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.94 11.15 61.95 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.831 1.205 . . . . 0.0 113.801 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 29.2 mtt -80.86 176.91 9.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.508 1.923 . . . . 0.0 111.228 173.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -108.04 -37.35 6.09 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -176.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -128.29 155.02 45.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.593 1.157 . . . . 0.0 112.52 -170.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.76 -24.94 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.31 1.044 . . . . 0.0 113.464 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.08 -28.91 68.57 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.728 1.211 . . . . 0.0 113.324 174.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -72.77 -15.66 61.65 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 118.383 0.538 . . . . 0.0 112.267 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.492 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -108.57 -31.06 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.017 0.927 . . . . 0.0 113.001 178.777 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.56 -41.11 53.81 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.07 1.348 . . . . 0.0 112.376 -172.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -55.4 -41.58 72.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.212 1.005 . . . . 0.0 112.639 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.51 -46.71 25.43 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.313 1.045 . . . . 0.0 111.49 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 84.2 mt -57.09 -51.94 67.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.493 1.117 . . . . 0.0 112.333 -178.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 -35.13 77.57 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.071 0.548 . . . . 0.0 111.247 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -64.43 -40.51 95.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 118.467 -0.777 . . . . 0.0 110.767 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.41 ' HA ' ' HG2' ' A' ' 150' ' ' ARG . 87.5 mtp -66.14 -34.8 78.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.673 1.189 . . . . 0.0 111.419 175.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.3 tttm -63.66 -40.28 96.45 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.531 -1.356 . . . . 0.0 113.112 169.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.69 -14.12 62.64 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 175.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ARG . . . . . 0.41 ' HG2' ' HA ' ' A' ' 147' ' ' MET . 13.9 ptm180 -114.11 14.7 18.32 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.5 t-80 72.11 37.84 0.95 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.531 1.533 . . . . 0.0 113.624 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -120.09 -32.61 4.14 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.657 1.583 . . . . 0.0 113.099 -179.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -127.92 164.08 23.06 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -148.79 115.41 5.94 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.972 2.109 . . . . 0.0 109.178 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.5 ttp -88.8 144.03 26.51 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.569 -0.707 . . . . 0.0 112.147 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.94 129.78 37.83 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.446 1.498 . . . . 0.0 110.102 171.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -74.16 -7.3 52.15 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 123.975 0.91 . . . . 0.0 113.147 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.87 -35.93 21.89 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.657 0.783 . . . . 0.0 112.865 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 2.1 t -144.47 15.77 1.64 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt 54.27 39.44 30.84 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.094 1.757 . . . . 0.0 113.306 -171.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -82.34 119.0 23.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.387 0.675 . . . . 0.0 109.857 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -86.18 123.19 31.19 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.025 1.33 . . . . 0.0 110.601 175.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.453 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -126.95 129.03 47.35 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 125.709 1.604 . . . . 0.0 108.083 -176.291 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.76 129.79 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 120.851 -1.155 . . . . 0.0 110.474 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.51 91.07 0.56 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.432 1.093 . . . . 0.0 111.255 -179.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 126.615 1.966 . . . . 0.0 112.056 177.86 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 N--CA 1.487 1.39 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 62.37 166.91 0.12 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 127.277 2.231 . . . . 0.0 115.292 -177.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 15.5 tpt -81.29 145.0 31.12 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.715 1.206 . . . . 0.0 112.312 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -144.53 143.3 30.77 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.325 1.45 . . . . 0.0 111.392 172.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 40.4 m -76.96 -48.0 2.69 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -176.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.72 169.6 18.02 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.816 2.344 . . . . 0.0 112.315 178.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -124.33 112.25 16.75 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.446 1.498 . . . . 0.0 111.702 175.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -99.46 148.1 24.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.754 1.222 . . . . 0.0 112.86 172.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.5 t -100.28 -29.15 12.6 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.46 1.904 . . . . 0.0 112.544 176.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -149.26 163.56 37.33 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.882 1.273 . . . . 0.0 112.708 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.19 -34.88 61.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.917 1.287 . . . . 0.0 113.34 -177.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -62.0 -46.67 88.18 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 118.689 0.677 . . . . 0.0 111.321 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -61.36 -49.24 77.75 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.664 1.185 . . . . 0.0 112.389 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.64 -46.7 73.99 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.629 1.172 . . . . 0.0 112.484 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.01 -43.73 94.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.793 173.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 140' ' ' VAL . 42.0 mt -56.7 -49.66 77.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.679 1.127 . . . . 0.0 111.446 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -64.14 -53.17 53.78 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.017 0.527 . . . . 0.0 110.61 -177.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.2 ttp85 -57.75 -42.61 84.32 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.862 1.265 . . . . 0.0 113.019 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -58.95 -54.03 51.73 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.288 1.035 . . . . 0.0 111.462 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.55 -18.81 62.92 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.75 -1.219 . . . . 0.0 113.137 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -73.04 -35.01 66.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 110.924 169.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.34 -39.26 17.85 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.405 0.682 . . . . 0.0 112.438 -172.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.59 -26.44 13.83 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.82 -167.4 26.85 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -173.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' PRO . . . . . 0.438 ' HB3' HG22 ' A' ' 163' ' ' THR . 44.0 Cg_endo -62.49 126.23 17.94 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.947 3.098 . . . . 0.0 113.821 -170.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -139.33 162.6 34.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.035 1.334 . . . . 0.0 110.857 179.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 54.3 mtt85 -80.69 159.75 25.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.36 -1.463 . . . . 0.0 111.955 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ALA . . . . . 0.525 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.72 -33.11 60.63 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.35 0.66 . . . . 0.0 112.552 -177.538 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.01 -41.9 94.94 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.971 -0.456 . . . . 0.0 111.582 177.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.0 -45.78 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.238 0.615 . . . . 0.0 109.691 174.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.525 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.92 -44.29 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 123.783 0.833 . . . . 0.0 110.344 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.512 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.8 -54.39 46.96 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.924 1.29 . . . . 0.0 110.194 -177.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -63.47 -34.44 77.76 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.357 0.663 . . . . 0.0 112.007 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.37 -24.73 63.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.443 HD11 HG13 ' A' ' 113' ' ' ILE . 4.3 mt -88.9 -11.83 43.45 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.642 1.577 . . . . 0.0 113.428 170.119 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.54 11.3 58.33 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.106 1.336 . . . . 0.0 113.991 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 30.5 mtt -81.33 177.03 9.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 111.29 173.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.94 -36.6 6.31 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 64.2 p -131.54 155.79 46.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.736 1.214 . . . . 0.0 112.572 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.57 -28.6 67.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.469 1.108 . . . . 0.0 113.523 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -66.09 -28.39 68.78 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 113.197 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -73.46 -15.34 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.533 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -108.11 -30.83 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.532 1.133 . . . . 0.0 113.192 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.95 -40.71 31.41 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.283 1.433 . . . . 0.0 112.406 -173.083 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -54.82 -40.86 70.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.511 1.124 . . . . 0.0 112.989 175.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -77.23 -46.46 23.14 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 176.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.48 -51.77 68.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.394 1.077 . . . . 0.0 112.127 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -33.14 74.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.636 0.774 . . . . 0.0 111.621 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.3 mtp-105 -70.17 -32.28 70.15 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.963 -0.46 . . . . 0.0 112.152 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -73.68 -34.09 64.72 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.663 1.185 . . . . 0.0 111.458 171.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -62.67 -42.52 99.66 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.236 -1.54 . . . . 0.0 112.047 171.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.1 m -67.05 -13.58 62.06 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ARG . . . . . 0.422 ' HG3' HD13 ' A' ' 152' ' ' LEU . 4.8 ptp180 -113.97 14.93 18.54 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 176.257 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.03 38.4 0.91 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.667 1.587 . . . . 0.0 112.94 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' LEU . . . . . 0.422 HD13 ' HG3' ' A' ' 150' ' ' ARG . 5.4 mp -121.52 -32.48 3.82 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.636 1.174 . . . . 0.0 113.752 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -123.89 164.65 18.84 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.158 0.983 . . . . 0.0 113.227 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.2 115.38 5.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.799 2.04 . . . . 0.0 108.854 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.1 ttp -88.43 143.52 26.94 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.708 -0.62 . . . . 0.0 111.9 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -90.21 130.77 36.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.018 1.327 . . . . 0.0 109.841 171.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.65 -9.12 58.34 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 123.899 0.88 . . . . 0.0 113.014 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -86.45 -36.46 19.07 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -172.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.9 t -143.09 15.86 1.9 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.049 0.94 . . . . 0.0 113.488 176.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 54.0 40.6 31.77 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.12 1.768 . . . . 0.0 113.307 -172.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.92 119.96 25.52 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.591 0.757 . . . . 0.0 109.875 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -86.09 123.82 31.82 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.06 1.344 . . . . 0.0 110.824 174.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.438 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -128.33 130.24 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.706 1.602 . . . . 0.0 108.743 -175.873 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.81 126.43 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 120.756 -1.215 . . . . 0.0 110.598 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.89 95.62 0.26 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.146 . . . . 0.0 112.48 -177.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.199 2.6 . . . . 0.0 113.559 171.192 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 48.6 mtt180 . . . . . 0 N--CA 1.475 0.814 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -59.43 -45.65 90.98 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.72 1.208 . . . . 0.0 111.839 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -58.3 -43.61 88.18 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.452 1.101 . . . . 0.0 112.786 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.67 -42.74 86.09 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.207 -0.933 . . . . 0.0 112.944 173.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.542 HD11 HG12 ' A' ' 140' ' ' VAL . 27.3 mt -55.52 -49.28 74.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.44 -53.56 50.39 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.176 0.59 . . . . 0.0 110.752 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -56.01 -44.36 78.6 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.967 1.307 . . . . 0.0 113.493 178.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -58.89 -54.22 49.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.389 1.076 . . . . 0.0 111.237 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.87 -18.96 62.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.821 -1.174 . . . . 0.0 113.187 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -73.36 -36.26 66.08 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.812 0.845 . . . . 0.0 111.294 169.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.46 -39.24 20.79 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.412 0.685 . . . . 0.0 112.408 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.05 -28.39 13.08 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.93 -168.74 24.91 Favored Glycine 0 N--CA 1.469 0.9 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 -172.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.433 ' HB3' HG22 ' A' ' 163' ' ' THR . 47.7 Cg_endo -62.96 128.26 22.56 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 124.004 3.136 . . . . 0.0 113.842 -170.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -139.97 163.17 33.39 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.07 1.348 . . . . 0.0 111.053 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -80.5 159.29 25.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.364 -1.46 . . . . 0.0 111.51 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.511 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.58 -33.52 60.41 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.558 0.743 . . . . 0.0 112.505 -177.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.25 -41.05 94.68 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.265 0.626 . . . . 0.0 111.627 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.6 t -59.44 -45.82 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.431 0.692 . . . . 0.0 109.154 174.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.511 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.99 -43.26 97.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.492 0.717 . . . . 0.0 110.67 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.553 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.46 -54.54 45.63 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.718 1.207 . . . . 0.0 110.044 -177.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -63.87 -34.61 78.32 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.325 0.65 . . . . 0.0 111.974 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.67 -25.39 64.78 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 113' ' ' ILE . 3.7 mt -89.36 -11.98 41.76 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.475 1.51 . . . . 0.0 113.437 170.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.7 11.46 59.17 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.674 1.13 . . . . 0.0 114.204 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.1 mtt -80.08 176.88 9.35 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.043 1.737 . . . . 0.0 110.982 171.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -107.96 -38.14 5.89 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -175.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 60.0 p -129.33 155.75 45.12 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.347 -170.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.52 -28.07 66.74 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.53 -27.6 67.11 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.77 1.228 . . . . 0.0 113.472 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.17 -22.47 62.96 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.301 0.5 . . . . 0.0 111.457 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.553 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -103.25 -30.31 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 O-C-N 121.634 -0.667 . . . . 0.0 112.693 -177.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.41 -39.51 32.96 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.265 1.426 . . . . 0.0 112.498 -172.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -53.49 -49.82 66.69 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.272 1.029 . . . . 0.0 111.823 173.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -70.37 -42.25 72.05 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.006 1.322 . . . . 0.0 111.666 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.93 -52.87 61.37 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.843 0.857 . . . . 0.0 111.983 -177.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -33.23 75.01 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.433 0.693 . . . . 0.0 111.087 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.4 mtp85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.053 0.388 . . . . 0.0 110.887 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.94 -32.73 71.15 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.157 0.983 . . . . 0.0 111.939 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -64.45 -39.43 93.8 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.464 -1.398 . . . . 0.0 112.918 169.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.5 t -68.35 -14.37 62.94 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -115.53 15.99 16.61 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 115.853 1.797 . . . . 0.0 115.853 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.85 38.51 0.93 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.465 1.506 . . . . 0.0 113.162 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 6.6 mp -121.22 -32.26 3.93 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.507 1.523 . . . . 0.0 113.391 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.472 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -126.8 163.42 23.61 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.163 0.892 . . . . 0.0 113.057 175.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -148.35 117.45 6.82 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.007 1.723 . . . . 0.0 109.187 176.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -85.31 143.03 28.93 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.98 -0.45 . . . . 0.0 111.416 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -87.1 131.04 34.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.966 1.306 . . . . 0.0 109.413 170.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -70.96 -14.59 62.42 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.977 0.911 . . . . 0.0 112.365 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -83.33 -40.79 19.02 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.659 0.783 . . . . 0.0 112.604 -170.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.2 t -138.93 15.21 2.66 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.506 1.122 . . . . 0.0 113.703 178.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 53.1 40.65 31.57 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.404 1.481 . . . . 0.0 112.813 -174.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.52 119.13 24.82 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.453 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -84.68 124.87 31.98 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.59 1.156 . . . . 0.0 110.925 175.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.0 OUTLIER -130.83 129.2 42.05 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.58 1.552 . . . . 0.0 108.542 -174.277 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.56 127.82 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 120.707 -1.245 . . . . 0.0 110.788 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -66.88 91.65 0.21 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.771 1.228 . . . . 0.0 112.41 -176.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 . . . . . 0 C--O 1.255 1.358 0 C-N-CA 128.484 2.713 . . . . 0.0 113.379 176.146 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 . . . . . 0 N--CA 1.475 0.811 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -64.59 -42.71 95.42 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.173 0.989 . . . . 0.0 110.311 -177.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -62.53 -49.4 75.5 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.953 0.901 . . . . 0.0 112.002 171.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.54 -45.95 84.47 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.822 0.849 . . . . 0.0 112.52 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 140' ' ' VAL . 29.3 mt -59.84 -50.18 81.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.213 1.005 . . . . 0.0 110.86 179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -64.71 -48.33 75.05 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.842 0.457 . . . . 0.0 110.813 -177.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.4 tpt85 -58.7 -44.58 90.36 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.924 1.29 . . . . 0.0 112.773 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.93 -52.99 62.7 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.678 1.191 . . . . 0.0 111.55 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.77 -19.33 63.51 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.99 -1.069 . . . . 0.0 112.648 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -72.89 -34.74 66.87 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.443 0.697 . . . . 0.0 110.82 169.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.81 -41.38 26.57 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.216 0.607 . . . . 0.0 112.098 -173.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -27.95 12.37 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.41 -167.43 24.78 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.316 -1.113 . . . . 0.0 110.316 -171.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -64.86 127.74 19.3 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.68 2.92 . . . . 0.0 114.322 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -139.42 163.25 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.446 1.499 . . . . 0.0 110.889 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -81.14 162.31 23.72 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 120.172 -1.58 . . . . 0.0 112.46 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.516 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.05 -32.04 63.7 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.364 0.666 . . . . 0.0 112.649 -178.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.55 -41.14 89.11 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.939 -0.475 . . . . 0.0 111.41 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.86 -45.38 91.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.976 0.511 . . . . 0.0 109.768 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.516 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -64.0 -42.65 96.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.629 0.772 . . . . 0.0 110.686 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.467 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.96 -54.44 44.79 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.713 1.205 . . . . 0.0 110.002 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -64.28 -33.85 76.77 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.222 0.609 . . . . 0.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.74 -24.77 63.59 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.094 0.775 . . . . 0.0 113.094 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.2 mt -89.66 -11.94 41.03 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.351 1.46 . . . . 0.0 113.118 169.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.93 11.05 60.68 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.781 1.181 . . . . 0.0 114.136 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.06 174.98 10.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.915 1.686 . . . . 0.0 110.803 172.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -107.79 -33.97 7.1 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.3 p -133.42 156.25 48.04 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.587 1.155 . . . . 0.0 112.239 -171.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.13 -27.94 66.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.376 1.07 . . . . 0.0 113.581 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.46 -26.38 65.47 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.982 1.313 . . . . 0.0 113.702 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -69.04 -24.1 64.14 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.424 0.556 . . . . 0.0 111.345 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.533 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.25 -30.95 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 123.868 0.867 . . . . 0.0 112.659 -174.765 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.99 -41.1 15.71 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 125.325 1.45 . . . . 0.0 112.408 -175.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.17 -44.08 71.18 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.541 1.137 . . . . 0.0 112.9 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.02 -43.17 55.24 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.628 1.171 . . . . 0.0 112.135 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -62.45 -51.81 66.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.72 0.808 . . . . 0.0 112.313 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -34.4 77.59 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.669 0.788 . . . . 0.0 110.903 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 2.4 mtm105 -61.39 -44.16 97.62 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.007 0.367 . . . . 0.0 110.595 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.76 -34.56 78.61 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.907 0.883 . . . . 0.0 111.394 177.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -65.29 -37.64 87.77 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.849 -1.157 . . . . 0.0 113.503 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.67 -18.52 63.57 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -113.72 15.71 18.71 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.32 39.22 0.96 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.451 1.501 . . . . 0.0 113.965 174.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.96 -32.11 3.79 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.228 1.811 . . . . 0.0 113.246 -178.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.444 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.7 mt -129.31 164.28 23.87 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.417 1.008 . . . . 0.0 113.47 176.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -148.85 118.23 6.9 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.52 1.928 . . . . 0.0 109.505 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -87.67 142.48 27.8 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.964 -1.085 . . . . 0.0 112.154 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.01 116.12 31.39 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 126.193 1.797 . . . . 0.0 108.001 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.42 -6.92 39.17 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.916 0.887 . . . . 0.0 112.693 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.7 mp0 -69.44 -33.78 73.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.407 1.883 . . . . 0.0 112.444 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 4.4 t -148.83 14.53 0.93 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.059 1.344 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 51.35 35.88 14.99 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 127.68 2.392 . . . . 0.0 113.28 -169.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.45 119.55 25.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.677 0.791 . . . . 0.0 110.35 -174.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -82.3 121.75 27.06 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.926 1.29 . . . . 0.0 111.091 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.75 133.6 54.92 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.164 1.786 . . . . 0.0 109.506 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.35 127.41 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.451 -1.406 . . . . 0.0 110.476 174.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.43 92.75 0.21 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.646 1.179 . . . . 0.0 111.838 -177.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.274 0 C-N-CA 127.539 2.336 . . . . 0.0 112.001 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -64.27 -39.13 93.3 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.777 0.831 . . . . 0.0 109.699 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -65.15 -51.7 59.58 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.972 0.509 . . . . 0.0 111.909 169.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.27 88.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.698 0.681 . . . . 0.0 111.891 -178.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.51 HD11 HG12 ' A' ' 140' ' ' VAL . 30.2 mt -58.34 -53.47 45.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.174 0.99 . . . . 0.0 110.643 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -61.42 -48.66 80.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.876 0.369 . . . . 0.0 111.256 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -64.32 -42.88 96.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.572 1.549 . . . . 0.0 112.427 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -60.57 -45.04 95.39 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.793 0.837 . . . . 0.0 112.4 174.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.409 ' CD1' HD21 ' A' ' 153' ' ' LEU . 82.7 mt -75.25 -25.5 58.11 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 121.355 -0.841 . . . . 0.0 112.725 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -69.12 -40.88 78.04 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.275 1.03 . . . . 0.0 110.4 169.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -75.39 -42.37 53.97 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -109.33 -16.98 13.91 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -173.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 100.89 -168.32 20.26 Favored Glycine 0 N--CA 1.466 0.67 0 C-N-CA 125.101 1.334 . . . . 0.0 110.557 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -63.09 127.37 20.07 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.757 2.305 . . . . 0.0 112.004 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -136.77 163.35 30.83 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.686 1.194 . . . . 0.0 110.712 176.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.4 mtt85 -80.79 160.48 24.85 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 120.194 -1.566 . . . . 0.0 111.726 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.528 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.94 -31.99 63.42 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -176.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.5 tp -65.62 -42.06 92.0 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.709 0.404 . . . . 0.0 111.31 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.27 -45.18 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.07 0.548 . . . . 0.0 109.575 174.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.528 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -63.38 -42.22 95.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 123.603 0.761 . . . . 0.0 110.542 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.452 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.44 -54.27 45.85 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.601 1.16 . . . . 0.0 109.827 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -65.64 -33.5 76.05 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.051 0.54 . . . . 0.0 112.138 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.27 -24.41 64.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.674 0.789 . . . . 0.0 112.87 176.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.41 HD11 HG13 ' A' ' 113' ' ' ILE . 3.2 mt -90.96 -11.96 37.4 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.064 1.745 . . . . 0.0 113.472 170.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.16 10.88 61.94 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.696 1.141 . . . . 0.0 114.307 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.24 175.72 9.7 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.017 1.727 . . . . 0.0 110.807 172.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -106.48 -35.01 7.21 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -134.16 156.99 47.35 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.431 1.092 . . . . 0.0 112.445 -170.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.5 -27.32 64.35 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.423 1.089 . . . . 0.0 113.7 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.42 -22.57 61.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.679 1.591 . . . . 0.0 114.129 176.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -70.86 -25.83 62.99 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.693 0.678 . . . . 0.0 111.14 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.51 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -104.85 -31.47 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.986 0.914 . . . . 0.0 112.692 -173.054 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -46.71 -38.23 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.559 1.544 . . . . 0.0 113.224 -175.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.38 -50.07 70.69 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.284 1.433 . . . . 0.0 112.107 174.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . 0.413 ' HB3' HD12 ' A' ' 113' ' ' ILE . 8.9 m-20 -70.1 -41.29 74.22 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.828 1.251 . . . . 0.0 111.601 176.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.07 -53.35 51.16 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.332 0.653 . . . . 0.0 112.276 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.4 -31.72 72.13 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.647 0.779 . . . . 0.0 111.106 177.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -60.16 -47.77 84.55 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.184 0.447 . . . . 0.0 110.489 172.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.3 mtp -64.9 -34.32 78.12 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.198 0.999 . . . . 0.0 111.368 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -63.77 -40.57 97.01 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.868 -1.145 . . . . 0.0 113.038 170.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.5 m -72.24 -13.74 61.6 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -113.91 14.98 18.62 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 174.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 72.02 39.21 0.83 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.541 1.537 . . . . 0.0 114.038 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.38 -31.57 3.78 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.118 1.767 . . . . 0.0 113.366 -178.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.477 HD11 ' CG2' ' A' ' 113' ' ' ILE . 12.5 mt -128.77 163.66 24.7 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.71 1.141 . . . . 0.0 113.967 176.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -148.08 121.59 9.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.367 1.867 . . . . 0.0 109.424 175.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 46.6 ttp -90.35 145.81 24.67 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.293 -0.88 . . . . 0.0 112.427 173.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -93.23 128.32 39.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.162 1.385 . . . . 0.0 109.053 170.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.64 -14.47 62.49 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 121.19 -0.944 . . . . 0.0 112.295 177.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -80.58 -38.53 29.29 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.69 1.196 . . . . 0.0 113.151 -169.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -138.6 14.73 2.73 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.27 1.028 . . . . 0.0 113.084 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.668 1.987 . . . . 0.0 113.181 -174.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -90.05 119.61 30.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.069 0.948 . . . . 0.0 110.457 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -87.67 118.32 27.08 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.634 1.574 . . . . 0.0 111.631 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -117.67 136.64 53.19 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.442 1.897 . . . . 0.0 112.012 172.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . 0.409 HG12 ' H ' ' A' ' 164' ' ' ILE . 0.4 OUTLIER -54.32 127.37 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.314 1.446 . . . . 0.0 111.084 174.02 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -66.41 89.6 0.14 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.092 1.357 . . . . 0.0 112.523 -176.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 128.041 2.536 . . . . 0.0 112.565 176.797 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 . . . . . 0 N--CA 1.482 1.129 0 CA-C-O 119.506 -0.283 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.38 -42.88 96.77 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.899 0.88 . . . . 0.0 110.952 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -51.23 64.48 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.634 0.774 . . . . 0.0 111.961 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.57 -41.11 93.94 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.408 0.683 . . . . 0.0 112.404 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.508 HG13 HD11 ' A' ' 132' ' ' LEU . 53.7 mt -58.8 -51.91 66.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 124.679 1.192 . . . . 0.0 111.048 175.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.7 -50.62 71.74 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.16 0.584 . . . . 0.0 110.888 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -61.92 -41.82 98.37 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.909 1.684 . . . . 0.0 112.238 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -59.89 -54.45 46.08 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.434 1.094 . . . . 0.0 111.496 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.95 -19.23 63.38 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.647 -1.283 . . . . 0.0 113.178 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -73.56 -36.26 65.59 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.988 0.915 . . . . 0.0 111.361 169.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -83.24 -39.53 20.77 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.261 0.624 . . . . 0.0 112.34 -173.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.32 -28.92 13.08 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -167.19 23.8 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -172.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.4 ' HB3' HG22 ' A' ' 163' ' ' THR . 56.4 Cg_endo -64.29 126.71 17.56 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 124.091 3.194 . . . . 0.0 114.262 -169.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -140.58 163.01 34.0 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.437 1.495 . . . . 0.0 111.274 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -79.56 161.87 25.7 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.058 -1.651 . . . . 0.0 112.561 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.527 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.48 -33.46 63.7 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.47 0.708 . . . . 0.0 112.249 -179.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -64.99 -41.79 95.09 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.023 -0.423 . . . . 0.0 111.289 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 28.4 t -59.45 -45.27 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.16 0.584 . . . . 0.0 109.856 174.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.527 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -62.47 -43.79 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 123.952 0.901 . . . . 0.0 110.43 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.507 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.33 -53.72 54.94 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.615 1.166 . . . . 0.0 110.015 -177.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -63.52 -34.0 76.81 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.2 0.6 . . . . 0.0 112.071 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.96 -25.58 64.62 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.508 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -87.93 -11.91 46.2 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.781 1.632 . . . . 0.0 112.998 169.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.05 11.29 57.75 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.894 1.235 . . . . 0.0 114.26 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 31.5 mtt -81.47 176.88 9.32 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.441 1.896 . . . . 0.0 111.414 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -108.23 -31.91 7.7 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 68.4 p -134.85 155.02 51.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.551 1.14 . . . . 0.0 112.492 -169.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.02 -26.04 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.224 1.009 . . . . 0.0 113.667 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -68.4 -27.64 66.39 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.654 1.182 . . . . 0.0 113.679 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.28 -23.19 62.83 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.044 0.45 . . . . 0.0 111.431 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.507 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -102.05 -31.37 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.212 -0.93 . . . . 0.0 112.666 -177.589 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.62 -40.87 20.64 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.51 1.524 . . . . 0.0 112.539 -173.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -42.38 71.74 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 175.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -78.12 -42.08 33.04 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.83 0.852 . . . . 0.0 112.216 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.5 -52.39 65.41 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.84 0.856 . . . . 0.0 112.398 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -35.01 79.27 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.409 0.684 . . . . 0.0 110.973 179.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.2 mtp-105 -60.77 -45.44 94.32 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.411 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.58 -35.63 81.62 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.32 1.048 . . . . 0.0 111.548 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -64.31 -38.52 91.32 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.839 -1.163 . . . . 0.0 113.529 171.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.1 t -69.72 -17.9 63.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 174.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -113.83 15.3 18.67 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.84 38.52 0.93 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.561 1.544 . . . . 0.0 113.613 175.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.47 -32.04 3.92 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.946 1.698 . . . . 0.0 113.343 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -127.35 163.94 22.89 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 119.386 0.993 . . . . 0.0 113.275 175.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -148.34 115.33 6.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.167 2.187 . . . . 0.0 108.988 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.8 ttp -87.97 143.97 26.81 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.493 -0.754 . . . . 0.0 111.679 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.91 124.77 45.58 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 125.15 1.38 . . . . 0.0 110.265 175.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.69 -5.79 40.0 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.21 -0.931 . . . . 0.0 113.03 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -83.51 -33.65 25.49 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.729 1.212 . . . . 0.0 112.731 -176.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.3 t -143.96 10.75 1.56 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.879 1.272 . . . . 0.0 113.336 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.3 mmmt 52.81 36.75 22.2 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.388 2.275 . . . . 0.0 113.439 -169.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.94 119.35 27.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.614 0.766 . . . . 0.0 110.101 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.98 122.53 27.9 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 124.72 1.208 . . . . 0.0 110.857 172.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.4 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.6 OUTLIER -126.14 130.61 51.37 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.145 1.778 . . . . 0.0 108.673 -178.077 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.37 127.81 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 120.747 -1.221 . . . . 0.0 110.506 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -67.99 89.17 0.29 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.922 1.289 . . . . 0.0 111.886 -177.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? . . . . . 0 C--O 1.251 1.174 0 C-N-CA 127.358 2.263 . . . . 0.0 111.297 -179.226 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 . . . . . 0 N--CA 1.475 0.8 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -55.92 -47.92 76.64 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.833 0.742 . . . . 0.0 111.728 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -58.13 -50.56 73.06 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.434 0.693 . . . . 0.0 112.467 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -42.72 99.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.318 176.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.493 HG13 HD11 ' A' ' 132' ' ' LEU . 48.9 mt -56.41 -51.49 63.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 111.148 177.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.7 t80 -65.13 -50.44 66.0 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.593 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -55.51 -49.1 73.48 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.73 1.212 . . . . 0.0 112.157 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -56.18 -53.91 51.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.03 0.932 . . . . 0.0 111.455 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.4 mt -70.77 -19.63 62.69 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 120.802 -1.187 . . . . 0.0 112.944 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.59 -37.4 68.16 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.915 0.78 . . . . 0.0 110.895 169.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -81.22 -39.52 25.25 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.16 -28.22 13.13 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.13 -167.84 25.41 Favored Glycine 0 N--CA 1.471 0.97 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 -171.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -64.55 128.38 21.08 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.761 2.974 . . . . 0.0 114.103 -169.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.9 mm-40 -140.29 162.79 34.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.366 1.466 . . . . 0.0 110.662 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -81.32 161.4 23.87 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 120.159 -1.588 . . . . 0.0 112.008 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.532 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.02 -31.93 63.54 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.052 0.541 . . . . 0.0 112.326 -177.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.2 tp -65.16 -42.0 94.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.948 -0.47 . . . . 0.0 111.219 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.6 t -59.0 -44.99 92.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.055 0.542 . . . . 0.0 109.803 173.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.532 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -63.88 -43.6 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.745 0.818 . . . . 0.0 110.78 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.405 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.08 -54.22 45.93 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.131 1.372 . . . . 0.0 110.153 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -64.17 -34.21 77.56 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.972 0.509 . . . . 0.0 111.964 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.99 -25.92 64.76 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.493 HD11 HG13 ' A' ' 113' ' ' ILE . 2.8 mt -86.68 -11.96 49.75 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.684 1.594 . . . . 0.0 113.134 169.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.37 11.67 60.72 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.708 1.147 . . . . 0.0 113.901 -178.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.0 mmt -85.64 175.69 8.61 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.448 1.899 . . . . 0.0 111.004 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -107.94 -36.58 6.32 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -173.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.7 p -127.12 155.7 42.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.598 1.159 . . . . 0.0 112.403 -171.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.28 -24.64 66.54 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.508 1.123 . . . . 0.0 113.265 175.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -67.4 -28.16 67.68 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.02 1.328 . . . . 0.0 113.402 174.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -71.74 -15.42 62.19 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.268 0.627 . . . . 0.0 112.479 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.413 HG12 HD11 ' A' ' 113' ' ' ILE . 0.1 OUTLIER -113.59 -31.09 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.427 1.091 . . . . 0.0 113.062 -179.731 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.32 -41.99 40.19 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.878 1.271 . . . . 0.0 112.213 -175.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 -55.33 -37.72 67.79 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.44 1.096 . . . . 0.0 113.215 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -81.16 -45.51 16.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.289 1.036 . . . . 0.0 111.558 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.5 mt -58.57 -52.51 65.37 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.327 -178.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.57 -34.48 77.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.036 0.934 . . . . 0.0 111.033 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.7 mtp-105 -64.28 -45.02 89.83 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.279 174.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.96 -35.36 79.9 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.14 0.976 . . . . 0.0 110.801 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -63.4 -40.17 96.5 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.8 -1.188 . . . . 0.0 112.996 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 43.2 m -73.96 -13.82 60.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.568 1.147 . . . . 0.0 114.032 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -113.85 15.42 18.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.753 1.621 . . . . 0.0 115.04 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 72.43 39.05 0.76 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.584 1.554 . . . . 0.0 114.178 175.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -122.82 -31.87 3.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.184 1.794 . . . . 0.0 113.371 -177.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.418 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -128.87 166.24 19.47 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.575 1.08 . . . . 0.0 113.732 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -149.17 119.43 7.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.322 1.849 . . . . 0.0 109.556 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.7 ttp -86.75 144.27 27.15 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.208 -0.932 . . . . 0.0 111.922 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -86.94 130.98 34.23 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.943 1.297 . . . . 0.0 109.813 171.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.06 -10.4 59.73 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 124.637 1.175 . . . . 0.0 112.957 173.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -87.99 -38.53 15.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.409 0.684 . . . . 0.0 112.758 -171.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.6 t -143.74 18.9 1.83 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.176 0.99 . . . . 0.0 113.656 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.78 39.3 28.5 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.303 1.841 . . . . 0.0 113.512 -175.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.6 118.3 25.02 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.935 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -82.92 124.32 30.24 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 110.725 175.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.74 133.13 50.94 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.792 1.637 . . . . 0.0 108.869 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.33 131.61 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.564 1.146 . . . . 0.0 110.743 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -67.87 98.01 0.7 Allowed 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.946 0.879 . . . . 0.0 111.212 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 . . . . . 0 C--O 1.254 1.294 0 C-N-CA 127.215 2.206 . . . . 0.0 112.108 -176.819 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.567 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.06 -48.16 70.88 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.138 0.881 . . . . 0.0 111.915 174.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -55.26 -52.1 64.5 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.313 1.045 . . . . 0.0 112.588 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -38.44 85.24 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.377 179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.47 HG13 HD11 ' A' ' 132' ' ' LEU . 44.3 mt -57.33 -50.42 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 119.287 0.949 . . . . 0.0 110.873 178.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -63.84 -51.36 65.02 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.329 0.652 . . . . 0.0 110.694 -178.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -57.95 -43.96 86.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.09 1.356 . . . . 0.0 112.921 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -59.66 -53.69 55.1 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.297 1.039 . . . . 0.0 111.422 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.68 -18.96 62.82 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.827 -1.171 . . . . 0.0 113.04 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -73.48 -36.36 65.8 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.696 0.799 . . . . 0.0 110.891 169.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.64 -38.55 23.37 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.28 0.632 . . . . 0.0 112.378 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.17 -27.7 13.08 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 95.81 -167.7 25.76 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.432 ' HB3' HG22 ' A' ' 163' ' ' THR . 49.7 Cg_endo -63.76 127.76 20.43 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 124.05 3.167 . . . . 0.0 114.228 -169.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -141.3 162.36 35.68 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.401 1.48 . . . . 0.0 111.281 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 -80.57 161.38 24.8 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 120.159 -1.588 . . . . 0.0 112.298 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.539 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.82 -32.33 63.47 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.19 0.596 . . . . 0.0 112.428 -177.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.3 tp -66.38 -39.98 89.42 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.832 -0.543 . . . . 0.0 111.347 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 32.4 t -59.88 -45.7 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 122.927 0.491 . . . . 0.0 109.676 173.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.539 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -63.16 -43.38 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.93 0.892 . . . . 0.0 110.688 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.58 -55.11 35.85 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.203 1.401 . . . . 0.0 110.15 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -64.67 -33.95 77.14 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.939 0.496 . . . . 0.0 111.925 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.85 -26.79 65.33 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 177.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.47 HD11 HG13 ' A' ' 113' ' ' ILE . 3.5 mt -85.96 -12.01 51.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.036 169.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.92 10.6 59.78 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.803 1.192 . . . . 0.0 113.937 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.3 mmt -83.44 176.81 8.8 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.402 1.881 . . . . 0.0 111.109 175.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 88.3 mmt-85 -108.14 -31.06 8.07 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -174.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 66.5 p -135.58 156.56 48.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.337 1.055 . . . . 0.0 112.335 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.17 -25.18 66.84 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.646 1.178 . . . . 0.0 113.371 176.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.04 -27.48 66.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.267 1.427 . . . . 0.0 113.476 174.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.89 -15.33 62.11 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.384 0.673 . . . . 0.0 112.258 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.446 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -114.54 -31.56 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 124.398 1.079 . . . . 0.0 113.061 -179.418 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -48.29 -40.72 25.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.056 1.343 . . . . 0.0 112.729 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -55.82 -44.38 77.86 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.727 1.211 . . . . 0.0 112.683 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.22 -43.02 58.79 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.653 1.181 . . . . 0.0 111.849 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.97 -52.43 65.03 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.124 0.97 . . . . 0.0 112.131 -176.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.11 79.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.304 0.641 . . . . 0.0 110.768 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 -64.3 -42.06 96.54 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 118.523 -0.751 . . . . 0.0 110.857 176.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.33 -34.91 79.22 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.187 0.995 . . . . 0.0 111.411 175.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -64.98 -38.26 90.39 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.791 -1.193 . . . . 0.0 113.232 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.58 -17.49 63.55 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -113.73 15.2 18.8 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.49 38.68 0.98 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.6 1.56 . . . . 0.0 113.824 175.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.8 mp -120.63 -32.67 3.99 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.008 1.723 . . . . 0.0 112.959 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.447 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -129.11 164.29 23.63 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 177.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -149.3 115.38 5.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.274 1.83 . . . . 0.0 109.603 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.3 ttp -84.0 145.15 28.67 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 111.802 174.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -91.11 130.36 37.01 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.049 1.339 . . . . 0.0 109.815 171.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.66 -9.22 58.44 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 124.084 0.954 . . . . 0.0 113.05 173.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -87.45 -36.67 17.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.564 0.746 . . . . 0.0 112.865 -172.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.1 t -143.62 18.01 1.84 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.222 1.009 . . . . 0.0 113.551 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 52.39 40.0 28.58 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 126.813 2.045 . . . . 0.0 113.826 -175.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.74 119.74 27.29 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.426 0.691 . . . . 0.0 109.79 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -82.96 125.15 31.07 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.773 1.229 . . . . 0.0 110.953 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.432 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.2 p -130.58 128.29 40.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.234 1.414 . . . . 0.0 108.594 -173.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.62 129.16 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 120.597 -1.315 . . . . 0.0 110.947 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.33 89.25 0.33 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.689 1.195 . . . . 0.0 112.216 -177.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 C--O 1.253 1.239 0 C-N-CA 127.204 2.202 . . . . 0.0 112.012 178.018 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 . . . . . 0 N--CA 1.478 0.948 0 CA-C-O 119.439 -0.315 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.52 -44.8 89.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.91 0.884 . . . . 0.0 110.058 173.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.16 -55.17 31.33 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.835 0.854 . . . . 0.0 113.081 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -40.53 93.11 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 118.769 0.713 . . . . 0.0 112.324 -177.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.485 HD11 HG12 ' A' ' 140' ' ' VAL . 55.5 mt -61.91 -51.87 67.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 119.426 1.012 . . . . 0.0 111.381 178.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -64.02 -48.41 76.47 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.419 0.288 . . . . 0.0 110.782 -177.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -55.57 -50.53 69.82 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.1 1.36 . . . . 0.0 112.382 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.87 -52.04 65.46 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.922 0.889 . . . . 0.0 111.568 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.28 -19.79 63.08 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.92 -1.112 . . . . 0.0 112.931 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -73.3 -37.02 66.36 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.904 0.774 . . . . 0.0 111.185 169.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -80.73 -38.39 28.83 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 -173.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.18 -27.99 12.91 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -168.87 24.85 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -172.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.412 ' HB3' HG22 ' A' ' 163' ' ' THR . 45.6 Cg_endo -62.06 128.35 23.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.033 3.155 . . . . 0.0 113.888 -171.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.5 mm-40 -141.34 163.94 31.58 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.222 1.409 . . . . 0.0 111.189 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 52.2 mtt85 -81.63 159.98 23.87 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 120.322 -1.486 . . . . 0.0 111.928 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.535 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.66 -32.45 63.23 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.221 0.608 . . . . 0.0 112.535 -177.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.18 -42.05 94.01 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.792 0.437 . . . . 0.0 111.38 177.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.02 -44.73 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.226 0.61 . . . . 0.0 109.647 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.535 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.432 0.693 . . . . 0.0 110.853 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.478 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.3 -53.97 49.48 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.052 1.341 . . . . 0.0 110.047 -178.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -63.95 -34.07 77.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.223 0.609 . . . . 0.0 112.022 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.82 -24.58 64.4 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.478 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -89.99 -11.94 40.12 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.386 1.474 . . . . 0.0 113.168 169.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.04 10.46 61.16 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 125.007 1.289 . . . . 0.0 113.942 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.5 mmt -82.78 173.57 11.75 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.906 1.682 . . . . 0.0 110.684 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -108.03 -30.65 8.33 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -169.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 67.7 p -135.97 155.98 49.45 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.633 1.173 . . . . 0.0 112.012 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.85 -27.65 65.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.31 -25.56 64.29 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.898 1.279 . . . . 0.0 113.721 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.22 -27.48 66.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.272 0.558 . . . . 0.0 111.113 176.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.485 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.52 -31.18 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 123.62 0.768 . . . . 0.0 112.457 -172.969 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.37 -41.0 12.89 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 112.401 -175.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -54.2 -44.32 71.51 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.732 1.213 . . . . 0.0 113.261 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.27 -42.64 44.88 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.999 0.92 . . . . 0.0 111.568 175.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.17 -52.84 63.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.923 . . . . 0.0 112.255 -177.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -34.03 77.44 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.783 0.833 . . . . 0.0 111.081 176.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.1 mtp85 -58.98 -46.99 86.75 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.39 173.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 41.1 mtm -64.28 -34.65 78.6 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.427 0.691 . . . . 0.0 112.274 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -65.01 -34.34 78.21 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.1 t -75.29 -16.27 60.44 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 173.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -114.04 15.23 18.42 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 6.0 t60 71.54 40.0 0.85 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.494 1.518 . . . . 0.0 114.068 175.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.85 -33.13 3.41 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.249 1.82 . . . . 0.0 113.304 -177.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.7 mt -129.51 163.95 24.81 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.737 1.153 . . . . 0.0 113.575 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -149.06 117.02 6.31 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.208 1.803 . . . . 0.0 109.772 176.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.0 ttp -85.38 143.66 28.49 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.106 0.562 . . . . 0.0 112.088 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.23 123.59 42.39 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 125.909 1.684 . . . . 0.0 109.688 172.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.25 -5.5 36.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.736 0.814 . . . . 0.0 112.876 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -75.84 -36.25 59.7 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.189 1.395 . . . . 0.0 112.355 -178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -148.2 16.45 1.06 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mptt 52.69 40.9 31.13 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.501 1.92 . . . . 0.0 113.004 -170.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -81.88 118.79 23.2 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.663 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -84.22 124.78 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.929 1.291 . . . . 0.0 110.819 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.412 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.5 p -130.47 127.99 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.173 1.389 . . . . 0.0 108.385 -172.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.47 130.48 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 120.606 -1.309 . . . . 0.0 111.077 -179.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.84 96.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 122.221 1.01 . . . . 0.0 111.793 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.806 2.443 . . . . 0.0 110.937 -176.362 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -60.84 -45.73 93.32 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.22 0.918 . . . . 0.0 111.108 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.39 -49.5 77.04 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -43.86 95.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.727 0.811 . . . . 0.0 112.381 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.475 HD11 HG12 ' A' ' 140' ' ' VAL . 34.5 mt -58.59 -50.84 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.65 1.18 . . . . 0.0 111.508 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -62.64 -51.49 67.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.945 0.498 . . . . 0.0 111.076 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -61.22 -39.78 91.53 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.436 1.094 . . . . 0.0 112.344 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.48 -54.24 47.91 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.472 1.109 . . . . 0.0 111.482 173.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.46 -18.87 63.76 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.737 -1.227 . . . . 0.0 112.989 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -73.79 -37.15 65.04 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.896 0.878 . . . . 0.0 111.454 169.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.67 -38.89 25.18 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.323 0.649 . . . . 0.0 112.278 -173.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.09 -29.16 11.92 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.76 -167.82 23.37 Favored Glycine 0 N--CA 1.469 0.857 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -172.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.455 ' HB3' HG22 ' A' ' 163' ' ' THR . 56.2 Cg_endo -65.23 128.14 19.82 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.772 2.981 . . . . 0.0 113.814 -170.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -139.06 162.66 34.39 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.585 1.554 . . . . 0.0 111.19 -178.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -79.27 158.16 27.61 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.196 -1.565 . . . . 0.0 111.05 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.541 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.85 -31.72 59.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.262 0.625 . . . . 0.0 112.439 -179.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.6 tp -64.86 -41.32 95.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.165 0.586 . . . . 0.0 111.699 177.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.24 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.565 0.746 . . . . 0.0 109.121 174.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.541 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.52 -43.63 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.529 0.732 . . . . 0.0 110.453 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.458 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.19 -55.58 31.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.234 1.414 . . . . 0.0 109.875 -178.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -63.85 -34.63 78.37 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.289 0.636 . . . . 0.0 111.986 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.24 64.28 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.451 HD11 HG13 ' A' ' 113' ' ' ILE . 4.2 mt -89.96 -11.96 40.16 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.488 1.515 . . . . 0.0 113.236 170.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 95.64 5.88 59.87 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.288 1.423 . . . . 0.0 114.248 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 20.4 mmm -80.93 173.77 12.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.557 1.543 . . . . 0.0 110.902 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -106.77 -29.91 9.25 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -170.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.9 p -137.77 156.37 48.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.412 1.085 . . . . 0.0 112.206 -171.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.94 -28.66 64.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.345 1.058 . . . . 0.0 113.833 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.74 -25.1 63.67 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.866 1.266 . . . . 0.0 113.705 176.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.23 -28.5 67.29 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.219 0.533 . . . . 0.0 110.915 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.475 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.01 -31.47 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.531 0.732 . . . . 0.0 112.334 -172.663 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.29 -41.64 6.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.029 1.732 . . . . 0.0 112.872 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -44.84 75.73 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.621 1.168 . . . . 0.0 112.769 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -77.19 -38.7 51.0 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.033 0.933 . . . . 0.0 112.625 175.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.19 -51.4 67.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.768 0.827 . . . . 0.0 112.215 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -33.12 75.29 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.969 -0.457 . . . . 0.0 111.005 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -64.47 -41.22 96.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.355 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.3 mtp -63.86 -37.23 86.64 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.258 0.936 . . . . 0.0 111.997 172.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 120.452 -1.405 . . . . 0.0 112.321 173.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.6 t -67.04 -14.32 62.78 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.231 1.412 . . . . 0.0 114.111 175.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 -113.25 13.23 19.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.547 1.139 . . . . 0.0 114.009 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.6 t60 69.01 39.37 1.79 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.122 1.369 . . . . 0.0 113.087 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -121.71 -34.2 3.45 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.196 1.398 . . . . 0.0 113.478 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.5 mp -119.63 160.35 22.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.799 1.24 . . . . 0.0 112.673 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -144.38 115.38 7.86 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.966 1.706 . . . . 0.0 109.87 174.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.4 ttp -85.83 144.12 27.89 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.298 0.57 . . . . 0.0 111.979 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.15 119.93 40.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.862 1.665 . . . . 0.0 107.999 173.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.97 -12.47 60.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.906 0.882 . . . . 0.0 113.286 -172.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -77.52 -35.0 53.84 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.428 1.491 . . . . 0.0 112.68 -170.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.8 t -135.09 11.79 3.58 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.701 1.2 . . . . 0.0 112.797 171.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm 53.44 38.94 29.17 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.128 1.771 . . . . 0.0 112.232 -169.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.82 116.05 19.76 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.344 0.658 . . . . 0.0 109.438 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -81.08 125.37 30.12 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.628 1.171 . . . . 0.0 110.533 171.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.455 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.8 OUTLIER -120.04 163.6 17.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 107.621 176.492 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.94 130.03 36.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 120.817 -1.177 . . . . 0.0 109.467 172.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -68.03 89.62 0.3 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.927 1.291 . . . . 0.0 111.539 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.4 ptt180 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 127.075 2.15 . . . . 0.0 113.004 178.254 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 . . . . . 0 N--CA 1.479 1.011 0 CA-C-O 119.567 -0.254 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -61.32 -43.14 99.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 122.943 0.497 . . . . 0.0 110.809 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.44 -48.79 80.3 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 122.003 -0.436 . . . . 0.0 112.091 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.565 0.746 . . . . 0.0 112.271 178.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.526 HD11 HG12 ' A' ' 140' ' ' VAL . 25.1 mt -55.89 -51.27 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.985 1.314 . . . . 0.0 111.332 177.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.415 ' CD2' HD12 ' A' ' 152' ' ' LEU . 37.0 t80 -63.49 -51.45 65.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.716 0.406 . . . . 0.0 111.025 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -56.49 -41.63 76.93 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.983 1.313 . . . . 0.0 112.67 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -62.75 -53.26 57.02 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.844 1.258 . . . . 0.0 111.49 175.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.71 -18.71 63.56 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.884 -1.135 . . . . 0.0 112.681 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -73.7 -37.12 65.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 118.938 0.79 . . . . 0.0 111.474 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.96 -38.71 27.24 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.384 0.674 . . . . 0.0 112.319 -173.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -28.69 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.76 -169.23 25.52 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.95 130.24 26.97 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.497 2.798 . . . . 0.0 114.09 -170.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -139.07 163.56 32.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.604 1.562 . . . . 0.0 110.832 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -78.61 157.67 28.65 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 120.21 -1.556 . . . . 0.0 111.106 177.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.504 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -53.26 -33.92 55.09 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.759 0.824 . . . . 0.0 112.524 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.07 -41.26 95.27 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.331 0.652 . . . . 0.0 111.879 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.6 t -59.61 -46.05 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.504 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -60.74 -43.18 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.347 0.659 . . . . 0.0 110.328 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.54 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.5 -54.21 49.44 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.024 -177.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.86 -33.51 76.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.313 0.645 . . . . 0.0 112.119 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.18 -25.13 64.19 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 123.673 0.789 . . . . 0.0 112.962 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.427 HD11 HG13 ' A' ' 113' ' ' ILE . 2.9 mt -89.95 -11.86 40.48 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.678 1.591 . . . . 0.0 113.334 170.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.48 11.48 59.45 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.689 1.138 . . . . 0.0 114.381 -178.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . 0.425 ' HE3' HD13 ' A' ' 132' ' ' LEU . 33.3 mtt -80.32 176.86 9.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.218 1.807 . . . . 0.0 111.116 171.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 86.0 mtt85 -107.69 -36.8 6.32 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -175.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -132.41 157.01 45.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.459 1.104 . . . . 0.0 112.506 -170.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.45 -27.51 66.14 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.78 1.029 . . . . 0.0 113.78 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -70.58 -23.5 62.6 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.644 1.578 . . . . 0.0 113.986 175.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -71.39 -25.17 62.24 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.276 0.489 . . . . 0.0 111.078 174.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.54 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -102.16 -31.45 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.404 0.682 . . . . 0.0 112.634 -175.723 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.38 -38.58 13.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.553 1.541 . . . . 0.0 113.325 -173.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -47.6 76.86 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.668 1.587 . . . . 0.0 112.441 174.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . 0.436 ' HB3' HD12 ' A' ' 113' ' ' ILE . 9.2 m-20 -72.72 -41.1 65.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.863 1.265 . . . . 0.0 111.904 176.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.42 -52.14 62.81 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.676 0.79 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.63 -33.67 76.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.844 0.458 . . . . 0.0 110.676 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -67.58 -39.29 84.87 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.03 177.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.74 -37.26 85.89 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 119.704 1.138 . . . . 0.0 111.924 171.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -64.79 -41.17 96.04 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.645 -1.284 . . . . 0.0 112.194 173.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -66.62 -13.99 61.85 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.994 1.318 . . . . 0.0 114.182 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -113.17 13.0 19.18 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.821 1.248 . . . . 0.0 113.972 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.5 t60 69.49 39.32 1.61 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.225 1.41 . . . . 0.0 113.324 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.415 HD12 ' CD2' ' A' ' 114' ' ' TYR . 4.5 mm? -121.47 -34.27 3.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.333 1.453 . . . . 0.0 113.153 -178.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.3 mp -119.9 160.76 22.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.931 1.293 . . . . 0.0 113.11 175.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -142.66 115.55 8.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.348 1.859 . . . . 0.0 110.185 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.2 ttp -88.27 143.66 26.9 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.087 -1.008 . . . . 0.0 112.25 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -89.39 130.81 35.7 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.849 1.26 . . . . 0.0 108.342 169.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.52 -14.11 61.16 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 121.09 -1.006 . . . . 0.0 112.536 175.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -85.35 -37.65 19.66 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -169.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -137.17 13.43 3.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.437 1.095 . . . . 0.0 113.148 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 52.52 42.14 31.25 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.221 1.809 . . . . 0.0 113.035 -176.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.13 117.61 25.98 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.903 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -83.98 120.0 25.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.633 1.173 . . . . 0.0 110.639 173.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.22 165.5 11.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.811 2.044 . . . . 0.0 108.786 170.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.24 127.65 39.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.471 1.108 . . . . 0.0 109.637 170.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -66.15 88.65 0.12 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.392 1.477 . . . . 0.0 112.027 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 45.8 ttm105 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 127.023 2.129 . . . . 0.0 112.037 178.877 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 111.478 0.177 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.96 -43.8 86.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.064 1.346 . . . . 0.0 111.045 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -64.92 -50.92 64.59 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.723 0.809 . . . . 0.0 112.385 176.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.45 -40.21 96.52 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.241 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.547 HG13 HD11 ' A' ' 132' ' ' LEU . 51.3 mt -57.91 -51.0 76.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 119.502 1.047 . . . . 0.0 110.992 176.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -63.54 -50.81 68.09 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.758 0.423 . . . . 0.0 110.663 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -58.96 -42.07 88.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.662 1.185 . . . . 0.0 112.963 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.47 -53.56 54.89 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.813 1.245 . . . . 0.0 111.685 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.91 -19.68 64.21 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.987 -1.071 . . . . 0.0 112.618 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -72.99 -37.21 67.08 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.899 0.88 . . . . 0.0 110.892 169.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -76.53 -41.26 47.36 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.947 0.499 . . . . 0.0 112.029 -174.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.12 -28.14 11.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -178.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.36 -168.48 25.53 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 -172.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -62.71 128.58 23.72 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.615 2.877 . . . . 0.0 114.155 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.0 mm-40 -138.96 164.21 30.32 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.132 1.373 . . . . 0.0 110.673 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 63.8 mtt85 -80.56 160.22 25.23 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.36 -1.462 . . . . 0.0 111.347 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.53 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.43 -33.07 63.24 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.278 0.631 . . . . 0.0 112.413 -177.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.3 tp -65.56 -39.79 92.07 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.255 0.622 . . . . 0.0 111.636 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.71 -46.3 96.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 174.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.53 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -61.35 -43.06 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.26 0.624 . . . . 0.0 110.488 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.517 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.9 -54.31 48.4 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.662 1.185 . . . . 0.0 110.145 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.78 -33.63 76.44 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.209 0.604 . . . . 0.0 112.131 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.87 65.37 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.396 0.678 . . . . 0.0 112.789 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.547 HD11 HG13 ' A' ' 113' ' ' ILE . 3.1 mt -88.47 -11.89 44.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.746 1.619 . . . . 0.0 113.394 169.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 11.66 60.18 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 124.704 1.145 . . . . 0.0 114.206 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.0 mtt -79.6 176.95 9.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.23 1.812 . . . . 0.0 111.21 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.99 -35.43 6.62 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 70.2 p -133.13 155.73 48.75 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.699 1.2 . . . . 0.0 112.37 -170.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.3 -27.33 65.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.162 0.985 . . . . 0.0 113.655 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.35 -26.92 65.84 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -68.79 -25.97 64.97 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.044 0.45 . . . . 0.0 111.241 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.517 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -100.68 -31.11 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 121.241 -0.912 . . . . 0.0 112.509 -176.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.67 -41.59 22.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.848 1.659 . . . . 0.0 112.216 -174.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -54.67 -41.15 69.82 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.567 1.147 . . . . 0.0 113.12 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -78.68 -44.45 23.62 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.559 0.744 . . . . 0.0 111.708 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.28 -52.45 65.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.274 1.029 . . . . 0.0 112.581 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.81 81.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.758 0.823 . . . . 0.0 111.036 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -62.85 -42.01 99.58 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.796 175.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 87.5 mtp -65.77 -34.39 78.07 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.111 0.964 . . . . 0.0 111.091 176.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.9 tttp -65.12 -37.41 87.34 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.998 -1.064 . . . . 0.0 113.399 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -70.05 -18.04 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 174.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -113.75 15.85 18.64 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.44 38.6 1.0 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.487 1.515 . . . . 0.0 113.947 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.39 -32.4 3.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.966 1.707 . . . . 0.0 113.281 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.4 mt -129.08 164.51 23.13 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.491 1.041 . . . . 0.0 113.541 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -147.95 118.55 7.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.711 2.004 . . . . 0.0 109.398 175.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.6 ttp -88.35 143.15 27.19 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.132 -0.98 . . . . 0.0 112.083 173.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -87.22 129.69 34.87 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.95 1.3 . . . . 0.0 109.312 170.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -71.1 -13.0 61.81 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 124.029 0.932 . . . . 0.0 112.432 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 63.6 mm-40 -83.69 -42.6 16.45 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.121 0.968 . . . . 0.0 112.729 -171.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 21.5 t -136.82 15.48 3.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.545 1.138 . . . . 0.0 113.499 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? 52.26 40.99 30.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.553 1.541 . . . . 0.0 112.801 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.15 118.0 24.45 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.637 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -85.03 121.94 28.53 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.713 1.205 . . . . 0.0 111.149 177.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.2 133.34 54.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.994 1.718 . . . . 0.0 109.559 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.81 127.49 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 O-C-N 120.454 -1.404 . . . . 0.0 110.632 176.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.8 92.46 0.22 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.694 1.198 . . . . 0.0 111.937 -177.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.268 1.827 . . . . 0.0 113.826 178.275 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 24.5 mtm180 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.88 -45.1 95.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.544 1.065 . . . . 0.0 111.062 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.36 -47.54 85.64 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.537 0.735 . . . . 0.0 111.469 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.5 -40.7 97.76 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.826 0.85 . . . . 0.0 113.254 177.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.499 HD11 HG12 ' A' ' 140' ' ' VAL . 30.2 mt -60.87 -50.24 81.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 124.359 1.063 . . . . 0.0 111.591 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -61.33 -51.35 69.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.662 0.267 . . . . 0.0 110.79 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -58.98 -42.08 89.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.19 1.396 . . . . 0.0 113.23 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -60.63 -53.68 54.54 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.28 1.032 . . . . 0.0 111.329 174.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.43 -19.6 62.97 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.768 -1.208 . . . . 0.0 112.877 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.95 -38.07 69.85 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.554 1.142 . . . . 0.0 111.043 169.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -82.16 -39.55 23.07 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.322 0.649 . . . . 0.0 112.295 -172.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.94 -28.94 12.1 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.75 -168.19 23.6 Favored Glycine 0 N--CA 1.47 0.946 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -171.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.33 129.12 20.75 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.562 2.841 . . . . 0.0 114.063 -169.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -140.61 161.03 38.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.774 1.629 . . . . 0.0 110.967 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -78.15 161.18 27.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 119.786 -1.822 . . . . 0.0 112.428 176.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.547 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.83 -31.67 62.91 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.259 0.624 . . . . 0.0 112.423 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -41.15 92.48 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.876 -0.515 . . . . 0.0 111.478 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.7 t -59.46 -46.59 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.003 0.521 . . . . 0.0 109.679 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.547 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -61.82 -43.43 97.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.087 0.955 . . . . 0.0 110.232 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.479 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.91 -54.63 44.35 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.904 1.282 . . . . 0.0 110.061 -177.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -64.45 -34.78 79.0 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.161 0.585 . . . . 0.0 112.02 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.29 -25.47 64.26 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.425 HD11 HG13 ' A' ' 113' ' ' ILE . 5.2 mt -89.98 -12.12 39.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.554 1.542 . . . . 0.0 113.36 171.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 9.95 62.08 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.757 1.17 . . . . 0.0 114.475 -177.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 18.0 mmt -80.63 176.64 9.62 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.34 1.456 . . . . 0.0 110.632 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -108.09 -31.64 7.86 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -172.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 58.1 p -136.83 156.96 47.81 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.417 1.087 . . . . 0.0 112.234 -171.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -29.89 65.26 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.337 1.055 . . . . 0.0 113.758 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -69.19 -25.12 64.17 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.849 1.26 . . . . 0.0 113.639 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.7 -27.55 66.05 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.193 0.451 . . . . 0.0 110.966 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.499 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.8 -31.14 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.503 0.721 . . . . 0.0 112.565 -173.378 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.65 -41.64 6.84 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.098 1.759 . . . . 0.0 112.591 -176.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -54.73 -44.94 74.0 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.74 1.216 . . . . 0.0 113.106 175.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.7 -41.72 52.87 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.96 0.904 . . . . 0.0 111.846 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.0 mt -60.84 -52.48 64.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.454 1.101 . . . . 0.0 112.493 -177.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -33.1 75.2 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.351 0.661 . . . . 0.0 110.981 178.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -64.45 -42.15 96.14 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.99 176.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.0 mtp -64.47 -35.94 82.58 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.182 0.901 . . . . 0.0 112.136 173.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.18 -41.79 94.28 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.465 -1.397 . . . . 0.0 112.605 173.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.4 t -63.75 -16.15 60.43 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.45 1.1 . . . . 0.0 113.632 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -113.55 15.28 19.01 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 70.83 37.14 1.38 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.393 1.477 . . . . 0.0 113.389 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -121.62 -33.48 3.6 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.124 1.37 . . . . 0.0 113.62 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.8 mp -118.73 161.76 19.58 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.623 1.169 . . . . 0.0 112.53 172.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -144.58 120.49 10.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.441 1.496 . . . . 0.0 110.374 172.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.9 ttp -87.84 144.44 26.59 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.193 -0.942 . . . . 0.0 112.111 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.71 126.17 41.69 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 125.414 1.486 . . . . 0.0 109.977 173.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -74.0 -4.11 33.33 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 124.702 1.201 . . . . 0.0 113.629 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.7 -33.91 15.6 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.552 1.141 . . . . 0.0 112.817 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.5 t -141.26 10.19 2.1 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.855 1.262 . . . . 0.0 113.225 -178.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 51.04 38.12 19.74 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 127.189 2.196 . . . . 0.0 113.584 -169.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.01 117.79 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.995 -176.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.56 121.53 26.43 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.391 1.076 . . . . 0.0 110.459 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.2 164.41 13.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.89 2.076 . . . . 0.0 108.754 171.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.61 126.92 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 124.154 0.982 . . . . 0.0 108.516 169.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -64.0 88.81 0.05 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.576 1.551 . . . . 0.0 112.02 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.269 0 C-N-CA 127.987 2.515 . . . . 0.0 113.203 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 118.39 -0.814 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -55.11 -46.67 75.59 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.099 0.863 . . . . 0.0 112.122 175.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -55.46 -51.92 65.35 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.344 1.058 . . . . 0.0 113.264 173.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -37.38 83.23 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.232 -0.917 . . . . 0.0 112.504 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.529 HD11 HG12 ' A' ' 140' ' ' VAL . 33.9 mt -56.86 -49.5 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.858 0.863 . . . . 0.0 110.59 178.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -62.83 -52.35 63.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.279 0.632 . . . . 0.0 110.658 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -57.74 -42.87 84.81 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.302 1.441 . . . . 0.0 113.184 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -60.11 -54.44 45.84 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.535 1.134 . . . . 0.0 111.375 173.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.7 mt -71.0 -19.18 62.55 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.668 -1.27 . . . . 0.0 113.079 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -72.55 -37.55 68.24 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.36 1.064 . . . . 0.0 110.803 169.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.21 -39.79 22.62 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.221 0.609 . . . . 0.0 112.312 -172.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.62 -29.15 12.84 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 177.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.25 -169.17 24.83 Favored Glycine 0 N--CA 1.47 0.91 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -171.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -64.24 128.97 22.84 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.007 3.138 . . . . 0.0 114.122 -170.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -140.63 163.41 32.95 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.535 1.534 . . . . 0.0 110.762 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -80.43 161.98 24.66 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.137 -1.602 . . . . 0.0 112.401 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.538 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.9 -32.11 63.46 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.481 0.712 . . . . 0.0 112.545 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.77 -41.72 91.71 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.96 -0.463 . . . . 0.0 111.412 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.47 -45.39 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 122.906 0.482 . . . . 0.0 109.882 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -62.44 -43.53 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.869 0.868 . . . . 0.0 110.468 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.52 -54.68 42.95 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.708 1.203 . . . . 0.0 109.989 -177.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.62 0.768 . . . . 0.0 111.971 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.86 -25.75 64.8 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.437 HD11 HG13 ' A' ' 113' ' ' ILE . 3.2 mt -89.45 -11.94 41.59 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.179 1.391 . . . . 0.0 113.192 170.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.9 6.73 63.28 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.226 1.393 . . . . 0.0 114.129 -177.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.7 mmt -77.76 172.54 13.27 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.281 1.432 . . . . 0.0 110.292 171.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -108.21 -30.33 8.43 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -135.1 156.75 48.49 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.742 1.217 . . . . 0.0 112.062 -174.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.43 -28.73 67.21 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -66.16 -29.38 69.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.894 1.278 . . . . 0.0 113.702 175.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.53 -26.78 67.31 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.641 0.257 . . . . 0.0 111.14 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.529 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.32 -31.11 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.598 0.759 . . . . 0.0 112.427 -175.72 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.18 -40.75 7.49 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.522 1.529 . . . . 0.0 113.066 -176.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -44.69 77.67 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.736 1.214 . . . . 0.0 113.021 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.49 -41.95 59.84 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.286 1.034 . . . . 0.0 111.828 175.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.44 -52.05 66.16 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.695 0.798 . . . . 0.0 112.463 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.75 -32.89 74.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.476 0.71 . . . . 0.0 111.241 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -70.28 -33.49 71.65 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.242 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 94.2 mtp -72.09 -34.29 68.54 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.598 1.159 . . . . 0.0 111.873 170.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 153' ' ' LEU . 25.4 tttp -63.05 -42.09 99.63 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 120.424 -1.423 . . . . 0.0 112.411 172.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.5 m -67.17 -14.67 63.13 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -114.13 13.77 18.11 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.84 1.793 . . . . 0.0 115.84 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.48 38.02 0.85 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.44 1.496 . . . . 0.0 113.269 178.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.2 mp -119.8 -32.09 4.34 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.086 1.354 . . . . 0.0 113.275 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.453 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.9 mt -126.94 164.44 21.47 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.128 0.971 . . . . 0.0 113.13 175.115 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -149.37 121.93 8.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.653 1.981 . . . . 0.0 109.197 174.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.5 ttp -90.22 144.73 25.59 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.191 -0.943 . . . . 0.0 112.063 173.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.12 126.01 42.0 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.126 1.37 . . . . 0.0 110.26 174.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.25 -6.52 43.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.114 0.966 . . . . 0.0 113.181 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -87.29 -34.78 18.78 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.441 1.096 . . . . 0.0 113.117 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.4 t -141.31 10.4 2.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.827 1.251 . . . . 0.0 113.176 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 51.37 38.87 22.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 127.061 2.145 . . . . 0.0 113.521 -169.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.83 119.1 26.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.374 0.67 . . . . 0.0 109.962 -175.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -83.51 119.96 25.34 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.518 1.127 . . . . 0.0 110.652 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.97 135.13 54.34 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.969 1.707 . . . . 0.0 108.915 175.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -55.38 130.04 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 120.57 -1.331 . . . . 0.0 109.622 169.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -67.37 86.8 0.18 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.959 1.303 . . . . 0.0 112.36 -177.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 60.8 ttp85 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.178 2.991 . . . . 0.0 113.552 -178.344 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.85 -44.81 96.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.068 0.947 . . . . 0.0 111.279 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.53 -46.58 82.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.654 0.781 . . . . 0.0 111.864 174.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.37 -44.95 92.66 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.649 0.78 . . . . 0.0 112.317 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.482 HD11 HG12 ' A' ' 140' ' ' VAL . 49.1 mt -58.65 -50.32 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.537 1.135 . . . . 0.0 111.12 178.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -64.77 -50.28 67.44 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.296 0.639 . . . . 0.0 110.821 -178.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -57.33 -45.95 83.77 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.727 1.211 . . . . 0.0 112.245 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -58.12 -53.99 52.02 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.093 0.957 . . . . 0.0 111.433 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.7 mt -70.48 -18.9 62.97 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.82 -1.175 . . . . 0.0 113.193 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -74.35 -36.12 63.59 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.557 0.743 . . . . 0.0 111.415 169.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -82.26 -38.67 24.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.528 0.731 . . . . 0.0 112.234 -173.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -28.62 12.7 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.42 -168.58 24.22 Favored Glycine 0 N--CA 1.469 0.898 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -172.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.444 ' HB3' HG22 ' A' ' 163' ' ' THR . 43.5 Cg_endo -62.49 127.88 22.05 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 124.066 3.177 . . . . 0.0 113.983 -171.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -141.28 163.12 33.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.205 1.402 . . . . 0.0 111.144 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 51.6 mtt85 -81.08 160.09 24.56 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.253 -1.529 . . . . 0.0 111.924 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.542 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.03 -31.82 63.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.138 0.575 . . . . 0.0 112.412 -177.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.9 tp -64.83 -41.93 95.35 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.946 -0.471 . . . . 0.0 111.401 176.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.68 -45.34 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.096 0.558 . . . . 0.0 109.679 174.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.542 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -62.64 -44.19 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 110.408 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.56 -54.76 40.01 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.105 1.362 . . . . 0.0 110.096 -177.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -64.0 -34.34 77.77 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.381 0.672 . . . . 0.0 112.102 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.17 -25.18 64.23 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 113' ' ' ILE . 2.8 mt -88.94 -12.0 42.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.378 1.471 . . . . 0.0 113.157 169.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.86 11.0 59.47 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.838 1.209 . . . . 0.0 114.119 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.1 mmt -83.43 176.3 9.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.964 1.706 . . . . 0.0 110.817 172.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -105.88 -38.81 6.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -171.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.7 p -130.45 156.37 44.87 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.459 1.103 . . . . 0.0 112.504 -169.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -28.2 63.82 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.42 1.088 . . . . 0.0 113.802 175.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -69.3 -25.37 64.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.889 1.276 . . . . 0.0 113.797 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.29 -27.95 66.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.12 0.486 . . . . 0.0 111.095 176.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.482 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.67 -31.25 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.539 0.736 . . . . 0.0 112.531 -173.109 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.2 -41.45 8.29 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.048 1.739 . . . . 0.0 112.485 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -54.39 -43.55 71.51 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.581 1.152 . . . . 0.0 113.34 175.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.34 -45.32 32.67 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.548 0.739 . . . . 0.0 111.384 175.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.37 -52.04 66.98 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.326 1.05 . . . . 0.0 112.662 -177.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -36.15 82.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.629 0.772 . . . . 0.0 110.779 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -68.09 -37.38 81.14 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.771 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.7 mtp -67.41 -34.65 77.69 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.944 0.898 . . . . 0.0 111.19 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -61.9 -46.04 91.11 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 113.136 171.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 59.9 m -63.74 -16.04 60.11 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 4.5 ptp85 -113.82 16.24 18.48 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 176.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.3 t60 71.42 37.92 1.09 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.863 1.265 . . . . 0.0 113.241 175.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -118.84 -33.4 4.23 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.767 1.627 . . . . 0.0 112.674 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mt -128.31 164.33 22.85 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -150.87 116.51 5.46 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.115 1.766 . . . . 0.0 109.771 176.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 47.2 ttp -85.79 144.57 27.67 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.713 -0.617 . . . . 0.0 111.943 174.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.05 125.83 38.91 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.514 1.526 . . . . 0.0 108.977 170.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.0 -8.15 54.41 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.005 -1.059 . . . . 0.0 112.885 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -84.44 -35.66 22.88 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.866 1.266 . . . . 0.0 112.835 -171.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -139.46 14.25 2.56 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.032 0.933 . . . . 0.0 112.955 172.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt 54.01 41.18 32.13 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 127.156 2.182 . . . . 0.0 113.134 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.17 119.79 25.95 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.558 0.743 . . . . 0.0 109.863 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -83.59 124.61 30.96 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.964 1.306 . . . . 0.0 110.69 173.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.4 p -129.34 127.34 40.88 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.379 1.471 . . . . 0.0 107.8 -174.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.0 130.3 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.58 -1.325 . . . . 0.0 110.451 178.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -67.74 86.83 0.22 Allowed 'General case' 0 CA--C 1.547 0.828 0 CA-C-O 122.657 1.218 . . . . 0.0 112.032 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 . . . . . 0 C--O 1.253 1.285 0 C-N-CA 128.139 2.576 . . . . 0.0 111.85 -175.176 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -58.62 -49.07 78.85 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.115 0.87 . . . . 0.0 111.01 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.56 -46.43 86.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.005 0.522 . . . . 0.0 112.058 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.4 -42.62 98.79 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.51 HG13 HD11 ' A' ' 132' ' ' LEU . 41.8 mt -58.27 -49.73 80.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 C-N-CA 124.612 1.165 . . . . 0.0 110.814 176.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -61.76 -51.66 67.42 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.013 0.925 . . . . 0.0 111.263 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.3 ttp85 -61.27 -42.47 98.7 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.53 1.532 . . . . 0.0 112.377 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.6 -52.11 66.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.701 0.8 . . . . 0.0 111.452 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.439 HD12 HD21 ' A' ' 153' ' ' LEU . 88.4 mt -71.3 -18.43 62.41 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.934 -1.104 . . . . 0.0 112.859 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.46 ' HA ' HD11 ' A' ' 164' ' ' ILE . 12.0 ttmt -69.96 -36.23 75.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.939 0.896 . . . . 0.0 110.386 169.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.28 -39.91 27.9 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -174.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -111.22 -21.04 12.1 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 86.85 -165.5 36.51 Favored Glycine 0 N--CA 1.476 1.34 0 CA-C-O 117.987 -1.451 . . . . 0.0 111.281 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -54.48 120.82 8.67 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.871 3.047 . . . . 0.0 114.531 -171.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -135.41 157.04 47.89 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.473 1.509 . . . . 0.0 110.175 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -76.63 162.21 27.92 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 119.932 -1.73 . . . . 0.0 111.867 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.541 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.84 -30.97 62.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.169 0.588 . . . . 0.0 112.139 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.15 -42.5 93.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.792 -0.568 . . . . 0.0 111.288 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 36.3 t -59.3 -45.7 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.059 0.544 . . . . 0.0 109.669 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.541 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -62.61 -44.14 99.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.859 0.864 . . . . 0.0 110.294 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.43 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -54.99 -54.58 41.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.291 1.436 . . . . 0.0 109.954 -178.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -64.53 -34.33 77.99 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.126 0.571 . . . . 0.0 112.036 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.83 -24.67 64.4 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.638 0.775 . . . . 0.0 113.041 177.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.51 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -90.04 -11.93 40.03 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.66 1.584 . . . . 0.0 113.533 169.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.82 10.82 61.08 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.736 1.16 . . . . 0.0 114.345 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.41 175.78 9.58 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.928 1.691 . . . . 0.0 110.76 172.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -107.74 -34.92 6.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -170.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.2 p -131.95 155.99 46.96 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.541 1.136 . . . . 0.0 112.308 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.04 -28.33 64.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.517 1.127 . . . . 0.0 113.688 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.33 -25.49 64.23 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.878 1.271 . . . . 0.0 113.734 176.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -68.27 -27.43 66.32 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.283 0.492 . . . . 0.0 110.941 177.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.472 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -102.42 -31.22 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 123.592 0.757 . . . . 0.0 112.655 -173.476 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.28 -41.64 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.636 1.575 . . . . 0.0 112.741 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -41.14 69.96 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.803 1.241 . . . . 0.0 113.423 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -79.77 -41.49 26.45 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.2 1.0 . . . . 0.0 112.147 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.07 -52.79 63.42 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.591 0.756 . . . . 0.0 112.226 -178.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -34.19 77.67 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.744 0.818 . . . . 0.0 111.204 178.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 16.1 mtp-105 -60.19 -46.41 89.81 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.636 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.4 ' HB2' HD12 ' A' ' 153' ' ' LEU . 33.9 mtp -66.95 -35.13 79.29 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.057 0.943 . . . . 0.0 111.793 178.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -65.33 -38.31 89.74 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.667 -1.27 . . . . 0.0 113.121 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.5 m -72.1 -14.55 61.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.213 1.005 . . . . 0.0 113.574 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -113.92 13.48 18.33 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 178.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 73.26 36.71 0.8 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.882 1.673 . . . . 0.0 114.148 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.7 mp -121.38 -32.08 3.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.069 1.348 . . . . 0.0 113.668 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.461 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.7 mt -124.34 164.01 20.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.453 1.101 . . . . 0.0 113.036 173.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -148.42 115.42 6.1 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.348 1.859 . . . . 0.0 108.82 179.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.5 ttp -87.67 141.41 28.63 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.379 -0.826 . . . . 0.0 111.587 172.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.84 126.68 37.02 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 124.713 1.205 . . . . 0.0 110.066 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -71.48 -7.12 45.42 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 124.273 1.029 . . . . 0.0 113.19 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -90.22 -33.88 16.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.595 1.158 . . . . 0.0 112.882 -173.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.2 t -142.0 11.26 1.99 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.99 1.316 . . . . 0.0 113.127 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 51.29 37.77 19.64 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 127.361 2.264 . . . . 0.0 114.106 -171.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -89.59 116.88 28.06 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.602 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -79.2 122.34 26.16 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.044 1.337 . . . . 0.0 111.294 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.4 t -132.18 144.43 50.66 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.809 1.643 . . . . 0.0 112.914 171.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . 0.46 HD11 ' HA ' ' A' ' 118' ' ' LYS . 0.4 OUTLIER -55.73 125.79 11.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 126.088 1.755 . . . . 0.0 111.29 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -65.1 89.42 0.08 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.503 1.521 . . . . 0.0 112.829 -177.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 77.0 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 128.301 2.64 . . . . 0.0 112.279 171.346 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.9 -42.99 90.88 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 110.882 177.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.11 -50.92 68.61 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.415 1.086 . . . . 0.0 112.552 175.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -38.34 90.24 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.619 -0.705 . . . . 0.0 112.525 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.507 HD11 HG12 ' A' ' 140' ' ' VAL . 44.1 mt -58.69 -50.75 78.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 119.248 0.931 . . . . 0.0 110.746 176.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.36 -51.65 66.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.987 0.115 . . . . 0.0 110.749 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -57.38 -43.92 84.01 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.184 1.394 . . . . 0.0 113.07 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -59.16 -54.08 51.06 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.194 0.998 . . . . 0.0 111.286 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -70.93 -19.43 62.58 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.744 -1.222 . . . . 0.0 113.087 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -73.14 -36.89 66.75 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.075 0.95 . . . . 0.0 111.117 169.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -82.42 -39.14 23.03 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.339 0.656 . . . . 0.0 112.27 -172.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.14 -28.1 12.87 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 177.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.71 -168.62 25.14 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.415 ' HB3' HG22 ' A' ' 163' ' ' THR . 41.8 Cg_endo -62.41 128.49 23.83 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.993 3.129 . . . . 0.0 114.006 -170.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -139.74 164.25 30.45 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.14 1.376 . . . . 0.0 111.09 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.4 mtt-85 -78.86 157.53 28.31 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 120.432 -1.418 . . . . 0.0 111.119 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.538 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -53.81 -32.76 53.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.597 0.759 . . . . 0.0 112.542 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.1 tp -64.9 -41.05 95.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.245 0.618 . . . . 0.0 111.684 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 31.6 t -60.66 -45.43 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -61.1 -44.07 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.428 0.691 . . . . 0.0 110.459 178.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.469 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.21 -54.98 38.79 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.131 1.372 . . . . 0.0 110.161 -177.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -64.27 -34.3 77.8 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.275 0.63 . . . . 0.0 111.959 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.71 -24.82 64.53 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.459 HD11 HG13 ' A' ' 113' ' ' ILE . 3.0 mt -90.51 -12.02 38.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.087 1.355 . . . . 0.0 113.301 170.126 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.55 11.65 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.129 1.347 . . . . 0.0 114.371 -178.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.3 mmt -84.0 176.13 9.06 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.036 1.734 . . . . 0.0 110.99 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -107.49 -35.64 6.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -171.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.9 p -133.34 157.22 46.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.608 1.163 . . . . 0.0 112.05 -171.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.15 -28.22 66.38 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 176.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.75 -28.95 68.82 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.741 1.216 . . . . 0.0 113.765 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.92 -28.36 68.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.949 0.404 . . . . 0.0 111.116 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.507 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -100.34 -31.19 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.706 0.802 . . . . 0.0 112.239 -174.403 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.07 -41.22 7.46 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.733 1.613 . . . . 0.0 112.617 -175.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -55.48 -42.86 74.96 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.63 1.172 . . . . 0.0 113.465 176.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -77.24 -43.46 33.42 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.072 0.949 . . . . 0.0 111.562 174.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.6 mt -59.08 -51.92 67.98 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.073 0.949 . . . . 0.0 112.433 -177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -34.71 78.29 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.327 0.651 . . . . 0.0 111.256 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.1 mtt-85 -64.24 -38.77 92.24 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.075 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 91.1 mtp -67.65 -35.49 78.98 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.155 0.982 . . . . 0.0 111.997 174.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -63.3 -38.62 91.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.787 -1.196 . . . . 0.0 113.132 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.3 t -68.96 -18.17 64.04 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -113.84 15.89 18.53 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.812 1.782 . . . . 0.0 115.812 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 72.02 38.43 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.328 1.451 . . . . 0.0 113.395 175.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -120.66 -32.83 3.94 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.978 1.711 . . . . 0.0 113.081 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -128.02 163.7 23.98 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.5 1.045 . . . . 0.0 113.781 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -147.69 115.45 6.4 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.959 2.103 . . . . 0.0 108.969 178.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.9 ttp -88.47 143.87 26.71 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.687 -0.633 . . . . 0.0 111.757 174.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -89.68 130.6 35.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.74 1.216 . . . . 0.0 109.619 170.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.97 -7.57 54.92 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.975 0.91 . . . . 0.0 113.016 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -88.72 -34.16 17.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.33 0.652 . . . . 0.0 112.548 -173.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.21 13.13 1.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.47 1.108 . . . . 0.0 113.78 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt 53.07 38.98 28.77 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 126.227 1.811 . . . . 0.0 113.265 -174.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.65 118.37 23.8 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.589 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -85.2 122.67 29.72 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.456 1.103 . . . . 0.0 110.866 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.415 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -127.24 129.44 47.78 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.752 1.621 . . . . 0.0 108.555 -176.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.74 128.86 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 110.813 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -68.27 90.56 0.35 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.792 1.237 . . . . 0.0 112.031 -177.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? . . . . . 0 C--O 1.253 1.286 0 C-N-CA 127.539 2.336 . . . . 0.0 111.346 176.986 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.79 -44.8 93.77 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.164 0.986 . . . . 0.0 110.585 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.88 -49.55 74.41 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.266 1.026 . . . . 0.0 112.45 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.63 -41.35 98.96 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.693 0.797 . . . . 0.0 113.028 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.477 HD11 HG12 ' A' ' 140' ' ' VAL . 45.6 mt -60.56 -49.55 83.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 124.231 1.012 . . . . 0.0 110.653 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.88 -50.67 69.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.668 0.387 . . . . 0.0 111.098 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -58.17 -44.46 88.0 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.351 1.46 . . . . 0.0 112.807 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -59.06 -53.34 59.46 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.951 0.9 . . . . 0.0 111.385 174.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.9 -18.69 62.66 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.773 -1.204 . . . . 0.0 113.104 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.4 ttmt -73.26 -36.0 66.29 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.69 0.796 . . . . 0.0 110.76 169.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.76 -38.34 21.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.403 0.681 . . . . 0.0 112.318 -171.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.93 -26.62 13.36 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 176.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.87 -167.25 26.68 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -172.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.433 ' HB3' HG22 ' A' ' 163' ' ' THR . 53.1 Cg_endo -63.86 128.2 21.43 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.943 3.095 . . . . 0.0 113.936 -170.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.6 mm-40 -139.52 164.65 29.34 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.27 1.428 . . . . 0.0 111.385 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -79.25 157.79 27.71 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.364 -1.46 . . . . 0.0 111.082 177.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.32 -32.74 57.36 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.456 0.702 . . . . 0.0 112.567 -179.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.0 tp -65.98 -39.65 90.53 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.197 0.599 . . . . 0.0 111.887 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 29.6 t -60.9 -45.06 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.531 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -61.6 -44.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.349 0.66 . . . . 0.0 110.639 178.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.448 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.71 -54.92 38.34 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 125.028 1.331 . . . . 0.0 110.028 -177.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.55 -33.41 75.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.216 0.606 . . . . 0.0 112.067 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.05 -25.16 64.32 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.465 HD11 HG13 ' A' ' 113' ' ' ILE . 2.4 mt -89.5 -12.06 41.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.209 1.404 . . . . 0.0 113.097 169.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.9 9.25 59.85 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 125.174 1.369 . . . . 0.0 114.276 -177.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.7 mmt -83.37 172.72 12.21 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.035 1.734 . . . . 0.0 111.06 174.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -107.96 -28.96 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -169.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.5 p -132.15 152.71 51.12 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.952 1.301 . . . . 0.0 111.739 -171.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.2 -29.77 65.94 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.99 0.916 . . . . 0.0 112.614 171.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -67.54 -23.69 65.46 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 127.231 2.213 . . . . 0.0 114.696 174.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -70.35 -28.65 65.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.792 0.724 . . . . 0.0 110.879 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.477 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -100.79 -31.51 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.276 0.63 . . . . 0.0 112.336 -171.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.42 -40.75 5.71 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.027 1.731 . . . . 0.0 113.021 -176.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -45.5 77.2 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.579 1.152 . . . . 0.0 112.852 175.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.98 -40.95 60.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.231 1.012 . . . . 0.0 112.012 174.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.0 -52.8 62.54 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.557 0.743 . . . . 0.0 112.173 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.04 -34.62 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.68 -0.637 . . . . 0.0 111.343 177.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -57.91 -48.06 81.0 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.45 0.3 . . . . 0.0 110.261 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -64.08 -35.6 81.28 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 124.325 1.05 . . . . 0.0 111.515 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -64.75 -37.12 86.54 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.983 -1.073 . . . . 0.0 113.689 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.1 t -71.55 -18.13 62.27 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -113.73 15.4 18.76 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.408 1.632 . . . . 0.0 115.408 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.64 39.27 0.89 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.502 1.521 . . . . 0.0 113.981 175.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.16 -32.63 3.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.177 1.791 . . . . 0.0 113.099 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.401 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -128.53 163.81 24.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.641 1.11 . . . . 0.0 113.665 176.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -148.79 115.24 5.89 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.795 2.038 . . . . 0.0 108.959 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -89.62 140.9 29.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.649 0.738 . . . . 0.0 111.76 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -102.05 107.0 17.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 126.259 1.823 . . . . 0.0 107.382 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.4 -8.88 20.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.089 1.356 . . . . 0.0 112.868 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -66.09 -32.83 74.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.68 1.992 . . . . 0.0 112.283 177.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.13 16.7 0.84 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 173.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.1 mptt 50.22 39.93 20.96 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.345 2.258 . . . . 0.0 113.384 -170.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.84 118.27 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.383 0.673 . . . . 0.0 109.866 174.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -83.4 127.05 33.37 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.333 1.453 . . . . 0.0 111.428 173.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.0 OUTLIER -132.81 129.54 38.66 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.859 1.664 . . . . 0.0 108.494 -174.581 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.39 129.52 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.497 -1.377 . . . . 0.0 111.301 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.1 88.01 0.41 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.046 1.338 . . . . 0.0 112.187 -177.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.845 2.058 . . . . 0.0 113.519 176.455 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -62.32 -45.78 91.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.291 0.567 . . . . 0.0 111.521 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.22 -48.93 75.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.718 0.807 . . . . 0.0 112.459 171.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.8 -46.21 88.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.005 0.922 . . . . 0.0 112.384 175.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.456 HD11 HG12 ' A' ' 140' ' ' VAL . 39.9 mt -57.73 -50.09 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 124.585 1.154 . . . . 0.0 110.948 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -65.09 -50.99 63.98 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.026 0.531 . . . . 0.0 110.893 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -56.7 -45.56 81.75 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.522 1.129 . . . . 0.0 111.968 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -58.44 -54.3 48.55 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.138 0.975 . . . . 0.0 111.434 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.4 mt -70.53 -18.9 62.94 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.861 -1.149 . . . . 0.0 113.359 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -74.34 -36.33 63.64 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.829 0.74 . . . . 0.0 111.423 169.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -81.77 -38.63 25.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.418 0.687 . . . . 0.0 112.322 -173.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.98 -29.03 12.78 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.66 -168.85 24.1 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -171.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.416 ' HB3' HG22 ' A' ' 163' ' ' THR . 48.7 Cg_endo -63.22 127.81 21.09 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.166 3.244 . . . . 0.0 114.126 -171.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -141.41 162.68 34.89 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.234 1.414 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -79.32 161.38 26.29 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 120.153 -1.592 . . . . 0.0 112.503 178.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.542 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.05 -32.39 64.01 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.244 0.618 . . . . 0.0 112.413 -179.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.6 tp -65.09 -41.58 94.88 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.789 -0.569 . . . . 0.0 111.365 177.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.5 t -59.34 -45.06 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.971 0.508 . . . . 0.0 109.896 174.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.542 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -63.73 -43.0 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.758 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.437 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.85 -54.78 40.33 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.13 1.372 . . . . 0.0 110.06 -178.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -63.93 -34.55 78.22 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.251 0.62 . . . . 0.0 111.939 -179.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.46 64.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 177.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.452 HD11 HG13 ' A' ' 113' ' ' ILE . 3.6 mt -88.48 -11.88 44.6 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.567 1.547 . . . . 0.0 113.256 170.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.99 10.86 60.81 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.697 1.141 . . . . 0.0 114.144 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.0 mmt -83.47 175.32 9.89 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.988 1.715 . . . . 0.0 110.859 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -107.8 -34.62 6.9 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -171.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 63.0 p -132.45 156.78 46.12 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.584 1.154 . . . . 0.0 112.181 -171.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.17 66.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 113.732 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.95 -29.73 69.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.913 1.285 . . . . 0.0 113.773 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -67.2 -23.97 65.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.861 0.362 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.456 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.77 -30.93 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.98 0.912 . . . . 0.0 112.598 -176.235 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.89 -40.62 14.4 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.326 1.45 . . . . 0.0 112.747 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -44.34 77.94 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.495 1.118 . . . . 0.0 112.744 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.64 -42.8 60.92 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.807 1.243 . . . . 0.0 111.814 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.2 mt -62.44 -51.52 67.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.981 0.913 . . . . 0.0 112.306 -176.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.68 -34.56 78.13 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.27 0.628 . . . . 0.0 110.792 178.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 83.1 mtt-85 -65.64 -37.26 86.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.492 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.7 mtp -68.83 -34.05 74.85 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.066 0.946 . . . . 0.0 111.874 173.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.5 tttp -64.09 -38.66 91.86 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.581 -1.324 . . . . 0.0 112.803 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.95 -14.61 62.79 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 175.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -114.08 14.83 18.39 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 175.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 72.06 38.51 0.89 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.363 1.465 . . . . 0.0 113.417 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -120.39 -32.86 4.0 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.767 1.627 . . . . 0.0 113.19 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.446 HD11 ' CG2' ' A' ' 113' ' ' ILE . 10.9 mt -128.08 163.44 24.6 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 176.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -150.23 115.37 5.39 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.165 1.786 . . . . 0.0 109.788 177.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 48.9 ttp -84.09 145.97 28.16 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.802 -0.561 . . . . 0.0 111.8 174.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -96.15 127.47 42.19 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 125.239 1.415 . . . . 0.0 109.135 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -71.14 -13.83 62.08 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.178 -0.951 . . . . 0.0 112.377 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -83.82 -37.34 22.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.678 1.191 . . . . 0.0 113.251 -169.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 6.3 t -134.16 8.11 3.71 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.196 1.398 . . . . 0.0 112.629 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm 51.53 40.18 26.38 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 127.053 2.141 . . . . 0.0 113.328 -170.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.31 120.38 28.54 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.612 -177.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -82.09 124.81 30.17 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.528 1.131 . . . . 0.0 110.801 172.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.416 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.5 p -130.36 128.0 40.54 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 108.465 -173.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.37 128.62 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 120.466 -1.397 . . . . 0.0 110.9 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -67.43 90.35 0.24 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.797 1.239 . . . . 0.0 111.89 -178.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 126.853 2.061 . . . . 0.0 112.475 179.012 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 . . . . . 0 N--CA 1.474 0.739 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -62.28 -45.69 92.13 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.708 0.803 . . . . 0.0 111.39 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.41 -48.55 76.71 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.912 0.885 . . . . 0.0 112.971 170.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.46 -44.41 95.89 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.061 0.944 . . . . 0.0 112.595 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.53 HD11 HG12 ' A' ' 140' ' ' VAL . 32.9 mt -57.97 -49.52 80.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 124.751 1.22 . . . . 0.0 110.799 178.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -64.28 -50.05 69.43 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.071 0.548 . . . . 0.0 110.711 -177.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -54.58 -51.42 65.34 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.188 0.995 . . . . 0.0 111.971 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -54.56 -52.0 63.45 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 123.851 0.86 . . . . 0.0 111.538 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.32 -19.89 61.58 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.943 -1.098 . . . . 0.0 113.004 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -73.05 -34.27 66.18 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.846 0.858 . . . . 0.0 110.704 169.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.63 -39.0 20.82 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.972 0.909 . . . . 0.0 111.706 -170.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.93 -27.93 11.87 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 176.001 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 98.49 -169.81 23.88 Favored Glycine 0 N--CA 1.474 1.186 0 CA-C-O 118.785 -1.008 . . . . 0.0 110.644 -171.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.4 ' HB3' HG22 ' A' ' 163' ' ' THR . 35.6 Cg_endo -61.5 129.53 28.42 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.985 3.124 . . . . 0.0 114.122 -171.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -139.76 164.82 28.94 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.304 1.442 . . . . 0.0 110.785 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.12 158.29 26.42 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.33 -1.481 . . . . 0.0 111.068 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.53 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.13 -33.2 57.23 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.445 0.698 . . . . 0.0 112.605 -178.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.88 -39.93 91.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.178 0.591 . . . . 0.0 111.848 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.0 t -60.31 -45.91 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.53 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -61.05 -43.4 96.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.364 0.665 . . . . 0.0 110.528 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.523 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.42 -54.33 48.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.636 1.175 . . . . 0.0 110.077 -177.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -65.28 -33.16 75.32 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.987 0.515 . . . . 0.0 112.061 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.93 -25.71 64.71 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.479 HD11 HG13 ' A' ' 113' ' ' ILE . 3.0 mt -88.6 -11.27 45.97 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.249 1.419 . . . . 0.0 113.319 169.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.84 11.54 61.65 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.762 1.172 . . . . 0.0 114.236 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.2 mtt -80.52 176.21 9.99 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.007 1.723 . . . . 0.0 111.211 171.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -108.14 -35.96 6.43 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.4 p -125.64 152.2 45.5 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.024 1.33 . . . . 0.0 112.312 -170.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.12 -29.09 68.39 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -64.13 -28.58 69.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.935 2.094 . . . . 0.0 114.453 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -72.26 -20.62 61.5 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.822 0.737 . . . . 0.0 111.439 177.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.53 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.48 -30.57 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.539 -0.725 . . . . 0.0 112.651 -177.157 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.07 -40.28 31.06 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.379 1.472 . . . . 0.0 112.389 -173.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -52.38 -50.17 62.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.682 1.193 . . . . 0.0 111.817 173.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -71.15 -41.76 70.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.009 1.324 . . . . 0.0 111.654 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.03 -52.9 61.06 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.109 0.963 . . . . 0.0 111.916 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -33.04 74.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.776 0.83 . . . . 0.0 111.302 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 48.0 mtp85 -61.52 -43.07 99.53 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.923 174.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.1 mtp -69.71 -33.18 72.15 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.997 0.919 . . . . 0.0 111.809 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -62.8 -42.23 99.62 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.488 -1.382 . . . . 0.0 112.408 170.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.9 m -69.18 -13.85 62.65 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 178.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -114.08 14.89 18.39 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 72.77 38.46 0.75 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.361 1.464 . . . . 0.0 113.588 176.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.1 mp -121.51 -31.9 3.94 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.731 1.612 . . . . 0.0 113.368 -178.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.445 HD11 ' CG2' ' A' ' 113' ' ' ILE . 10.0 mt -127.35 164.19 22.34 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -148.38 115.84 6.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.809 1.643 . . . . 0.0 110.259 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -86.15 144.27 27.58 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.343 -0.848 . . . . 0.0 112.034 174.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.37 130.61 34.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.71 1.204 . . . . 0.0 109.236 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -73.82 -9.34 58.55 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 124.679 1.192 . . . . 0.0 112.878 176.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -90.79 -39.1 12.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -174.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.64 15.12 2.34 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.72 40.84 31.11 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 126.162 1.785 . . . . 0.0 113.045 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.42 117.35 23.58 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.47 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.52 122.32 28.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.197 0.999 . . . . 0.0 110.637 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.4 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.2 OUTLIER -126.46 131.17 51.72 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 125.513 1.525 . . . . 0.0 108.434 -178.438 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -52.23 133.33 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.115 -0.991 . . . . 0.0 110.702 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -70.26 102.12 2.05 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 111.193 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.707 2.003 . . . . 0.0 112.758 173.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 . . . . . 0 N--CA 1.474 0.733 0 CA-C-O 118.698 -0.668 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -53.87 -48.65 69.82 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.873 0.76 . . . . 0.0 112.061 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.56 -51.25 70.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.018 0.927 . . . . 0.0 112.155 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.09 -42.33 99.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 118.589 -0.72 . . . . 0.0 112.262 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.475 HD11 HG12 ' A' ' 140' ' ' VAL . 49.5 mt -57.75 -51.31 71.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.66 1.118 . . . . 0.0 111.256 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -65.26 -49.3 70.14 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.124 0.57 . . . . 0.0 110.423 -176.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.7 tpt85 -58.59 -43.86 89.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.559 1.144 . . . . 0.0 112.825 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -60.75 -53.85 52.33 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 124.756 1.222 . . . . 0.0 111.558 175.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.21 -19.54 63.96 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.957 -1.089 . . . . 0.0 112.705 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -73.84 -35.48 64.82 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.729 0.695 . . . . 0.0 111.482 169.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -77.72 -41.37 38.09 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.158 0.583 . . . . 0.0 111.957 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.58 -28.01 11.99 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -178.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.29 -166.7 24.51 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -172.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.453 ' HB3' HG22 ' A' ' 163' ' ' THR . 47.8 Cg_endo -62.97 125.91 16.91 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.896 3.064 . . . . 0.0 114.124 -169.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -139.13 162.24 35.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.205 1.402 . . . . 0.0 110.973 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -81.12 160.25 24.48 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.282 -1.511 . . . . 0.0 112.032 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.2 -32.8 62.51 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.6 0.636 . . . . 0.0 112.522 -177.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.7 tp -65.74 -40.87 92.59 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.957 -0.464 . . . . 0.0 111.493 177.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.1 t -59.14 -46.35 92.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.169 0.587 . . . . 0.0 109.638 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.531 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -62.26 -43.36 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.834 0.853 . . . . 0.0 110.547 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.492 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -58.06 -53.88 53.23 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.504 1.121 . . . . 0.0 110.185 -178.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.04 -34.31 77.73 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.072 0.549 . . . . 0.0 111.984 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.91 -26.33 65.93 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.422 0.689 . . . . 0.0 112.833 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.467 HD11 HG13 ' A' ' 113' ' ' ILE . 4.1 mt -86.35 -11.94 50.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.658 1.583 . . . . 0.0 113.19 169.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.94 11.15 61.95 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.831 1.205 . . . . 0.0 113.801 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 29.2 mtt -80.86 176.91 9.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.508 1.923 . . . . 0.0 111.228 173.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -108.04 -37.35 6.09 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -176.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -128.29 155.02 45.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.593 1.157 . . . . 0.0 112.52 -170.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.76 -24.94 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.31 1.044 . . . . 0.0 113.464 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.08 -28.91 68.57 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.728 1.211 . . . . 0.0 113.324 174.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -72.77 -15.66 61.65 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 118.383 0.538 . . . . 0.0 112.267 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.492 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -108.57 -31.06 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.017 0.927 . . . . 0.0 113.001 178.777 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.56 -41.11 53.81 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.07 1.348 . . . . 0.0 112.376 -172.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -55.4 -41.58 72.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.212 1.005 . . . . 0.0 112.639 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.51 -46.71 25.43 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.313 1.045 . . . . 0.0 111.49 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 84.2 mt -57.09 -51.94 67.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.493 1.117 . . . . 0.0 112.333 -178.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 -35.13 77.57 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.071 0.548 . . . . 0.0 111.247 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -64.43 -40.51 95.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 118.467 -0.777 . . . . 0.0 110.767 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.41 ' HA ' ' HG2' ' A' ' 150' ' ' ARG . 87.5 mtp -66.14 -34.8 78.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.673 1.189 . . . . 0.0 111.419 175.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.3 tttm -63.66 -40.28 96.45 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.531 -1.356 . . . . 0.0 113.112 169.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.69 -14.12 62.64 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 175.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . 0.41 ' HG2' ' HA ' ' A' ' 147' ' ' MET . 13.9 ptm180 -114.11 14.7 18.32 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.5 t-80 72.11 37.84 0.95 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.531 1.533 . . . . 0.0 113.624 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -120.09 -32.61 4.14 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.657 1.583 . . . . 0.0 113.099 -179.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -127.92 164.08 23.06 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -148.79 115.41 5.94 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.972 2.109 . . . . 0.0 109.178 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.5 ttp -88.8 144.03 26.51 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.569 -0.707 . . . . 0.0 112.147 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.94 129.78 37.83 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.446 1.498 . . . . 0.0 110.102 171.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -74.16 -7.3 52.15 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 123.975 0.91 . . . . 0.0 113.147 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.87 -35.93 21.89 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.657 0.783 . . . . 0.0 112.865 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 2.1 t -144.47 15.77 1.64 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt 54.27 39.44 30.84 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.094 1.757 . . . . 0.0 113.306 -171.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -82.34 119.0 23.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.387 0.675 . . . . 0.0 109.857 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -86.18 123.19 31.19 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.025 1.33 . . . . 0.0 110.601 175.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.453 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -126.95 129.03 47.35 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 125.709 1.604 . . . . 0.0 108.083 -176.291 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.76 129.79 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 120.851 -1.155 . . . . 0.0 110.474 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.51 91.07 0.56 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.432 1.093 . . . . 0.0 111.255 -179.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 126.615 1.966 . . . . 0.0 112.056 177.86 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 111.321 0.119 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -61.36 -49.24 77.75 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.664 1.185 . . . . 0.0 112.389 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.64 -46.7 73.99 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.629 1.172 . . . . 0.0 112.484 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.01 -43.73 94.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.793 173.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 140' ' ' VAL . 42.0 mt -56.7 -49.66 77.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.679 1.127 . . . . 0.0 111.446 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -64.14 -53.17 53.78 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.017 0.527 . . . . 0.0 110.61 -177.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.2 ttp85 -57.75 -42.61 84.32 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.862 1.265 . . . . 0.0 113.019 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -58.95 -54.03 51.73 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.288 1.035 . . . . 0.0 111.462 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.55 -18.81 62.92 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.75 -1.219 . . . . 0.0 113.137 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -73.04 -35.01 66.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 110.924 169.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.34 -39.26 17.85 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.405 0.682 . . . . 0.0 112.438 -172.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.59 -26.44 13.83 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.82 -167.4 26.85 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -173.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' PRO . . . . . 0.438 ' HB3' HG22 ' A' ' 163' ' ' THR . 44.0 Cg_endo -62.49 126.23 17.94 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.947 3.098 . . . . 0.0 113.821 -170.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -139.33 162.6 34.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.035 1.334 . . . . 0.0 110.857 179.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 54.3 mtt85 -80.69 159.75 25.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.36 -1.463 . . . . 0.0 111.955 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . 0.525 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.72 -33.11 60.63 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.35 0.66 . . . . 0.0 112.552 -177.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.01 -41.9 94.94 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.971 -0.456 . . . . 0.0 111.582 177.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.0 -45.78 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.238 0.615 . . . . 0.0 109.691 174.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.525 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.92 -44.29 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 123.783 0.833 . . . . 0.0 110.344 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.512 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.8 -54.39 46.96 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.924 1.29 . . . . 0.0 110.194 -177.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -63.47 -34.44 77.76 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.357 0.663 . . . . 0.0 112.007 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.37 -24.73 63.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.443 HD11 HG13 ' A' ' 113' ' ' ILE . 4.3 mt -88.9 -11.83 43.45 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.642 1.577 . . . . 0.0 113.428 170.119 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.54 11.3 58.33 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.106 1.336 . . . . 0.0 113.991 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 30.5 mtt -81.33 177.03 9.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 111.29 173.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.94 -36.6 6.31 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 64.2 p -131.54 155.79 46.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.736 1.214 . . . . 0.0 112.572 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.57 -28.6 67.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.469 1.108 . . . . 0.0 113.523 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -66.09 -28.39 68.78 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 113.197 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -73.46 -15.34 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' VAL . . . . . 0.533 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -108.11 -30.83 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.532 1.133 . . . . 0.0 113.192 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.95 -40.71 31.41 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.283 1.433 . . . . 0.0 112.406 -173.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -54.82 -40.86 70.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.511 1.124 . . . . 0.0 112.989 175.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -77.23 -46.46 23.14 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 176.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.48 -51.77 68.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.394 1.077 . . . . 0.0 112.127 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -33.14 74.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.636 0.774 . . . . 0.0 111.621 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.3 mtp-105 -70.17 -32.28 70.15 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.963 -0.46 . . . . 0.0 112.152 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -73.68 -34.09 64.72 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.663 1.185 . . . . 0.0 111.458 171.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -62.67 -42.52 99.66 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.236 -1.54 . . . . 0.0 112.047 171.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.1 m -67.05 -13.58 62.06 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . 0.422 ' HG3' HD13 ' A' ' 152' ' ' LEU . 4.8 ptp180 -113.97 14.93 18.54 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 176.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.03 38.4 0.91 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.667 1.587 . . . . 0.0 112.94 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' LEU . . . . . 0.422 HD13 ' HG3' ' A' ' 150' ' ' ARG . 5.4 mp -121.52 -32.48 3.82 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.636 1.174 . . . . 0.0 113.752 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -123.89 164.65 18.84 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.158 0.983 . . . . 0.0 113.227 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.2 115.38 5.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.799 2.04 . . . . 0.0 108.854 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.1 ttp -88.43 143.52 26.94 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.708 -0.62 . . . . 0.0 111.9 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -90.21 130.77 36.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.018 1.327 . . . . 0.0 109.841 171.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.65 -9.12 58.34 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 123.899 0.88 . . . . 0.0 113.014 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -86.45 -36.46 19.07 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -172.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.9 t -143.09 15.86 1.9 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.049 0.94 . . . . 0.0 113.488 176.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 54.0 40.6 31.77 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.12 1.768 . . . . 0.0 113.307 -172.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.92 119.96 25.52 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.591 0.757 . . . . 0.0 109.875 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -86.09 123.82 31.82 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.06 1.344 . . . . 0.0 110.824 174.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.438 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -128.33 130.24 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.706 1.602 . . . . 0.0 108.743 -175.873 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.81 126.43 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 120.756 -1.215 . . . . 0.0 110.598 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.89 95.62 0.26 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.146 . . . . 0.0 112.48 -177.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.199 2.6 . . . . 0.0 113.559 171.192 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.3 m . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -96.93 -14.49 21.7 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -177.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 84.3 mtp -90.69 165.2 13.83 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.932 1.293 . . . . 0.0 112.371 177.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.31 150.14 43.99 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.114 0.966 . . . . 0.0 112.917 177.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.7 p -84.73 -32.3 0.48 Allowed Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 117.793 2.516 . . . . 0.0 117.793 -170.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -83.62 165.98 13.78 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 CA-C-N 123.287 2.21 . . . . 0.0 112.427 -175.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.3 mm100 -124.24 117.0 23.58 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.296 1.838 . . . . 0.0 110.924 176.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -105.99 143.17 34.51 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.245 1.018 . . . . 0.0 111.861 171.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 74.5 m -88.02 -30.63 19.82 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.173 1.389 . . . . 0.0 112.961 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -155.19 168.3 27.51 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.77 1.228 . . . . 0.0 112.298 -172.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -52.98 -35.83 59.61 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.856 1.262 . . . . 0.0 113.005 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 48.6 mtt180 -60.88 -53.92 51.39 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.437 1.017 . . . . 0.0 111.684 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -59.43 -45.65 90.98 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.72 1.208 . . . . 0.0 111.839 -178.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -58.3 -43.61 88.18 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.452 1.101 . . . . 0.0 112.786 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.67 -42.74 86.09 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.207 -0.933 . . . . 0.0 112.944 173.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.542 HD11 HG12 ' A' ' 140' ' ' VAL . 27.3 mt -55.52 -49.28 74.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 C-N-CA 124.176 0.99 . . . . 0.0 110.865 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.44 -53.56 50.39 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.176 0.59 . . . . 0.0 110.752 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -56.01 -44.36 78.6 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.967 1.307 . . . . 0.0 113.493 178.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -58.89 -54.22 49.52 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.389 1.076 . . . . 0.0 111.237 175.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.2 mt -70.87 -18.96 62.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.821 -1.174 . . . . 0.0 113.187 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -73.36 -36.26 66.08 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.812 0.845 . . . . 0.0 111.294 169.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.46 -39.24 20.79 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.412 0.685 . . . . 0.0 112.408 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.05 -28.39 13.08 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.93 -168.74 24.91 Favored Glycine 0 N--CA 1.469 0.9 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 -172.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.433 ' HB3' HG22 ' A' ' 163' ' ' THR . 47.7 Cg_endo -62.96 128.26 22.56 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 124.004 3.136 . . . . 0.0 113.842 -170.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -139.97 163.17 33.39 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 125.07 1.348 . . . . 0.0 111.053 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 88.7 mtt180 -80.5 159.29 25.59 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 120.364 -1.46 . . . . 0.0 111.51 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.511 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.58 -33.52 60.41 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.558 0.743 . . . . 0.0 112.505 -177.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.25 -41.05 94.68 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.265 0.626 . . . . 0.0 111.627 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.6 t -59.44 -45.82 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.431 0.692 . . . . 0.0 109.154 174.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.511 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.99 -43.26 97.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.492 0.717 . . . . 0.0 110.67 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.553 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.46 -54.54 45.63 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.718 1.207 . . . . 0.0 110.044 -177.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.8 mt-30 -63.87 -34.61 78.32 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.325 0.65 . . . . 0.0 111.974 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.67 -25.39 64.78 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 113' ' ' ILE . 3.7 mt -89.36 -11.98 41.76 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.475 1.51 . . . . 0.0 113.437 170.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.7 11.46 59.17 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 124.674 1.13 . . . . 0.0 114.204 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.1 mtt -80.08 176.88 9.35 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.043 1.737 . . . . 0.0 110.982 171.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -107.96 -38.14 5.89 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -175.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 60.0 p -129.33 155.75 45.12 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.655 1.182 . . . . 0.0 112.347 -170.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.52 -28.07 66.74 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.53 -27.6 67.11 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.77 1.228 . . . . 0.0 113.472 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -70.17 -22.47 62.96 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.301 0.5 . . . . 0.0 111.457 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.553 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -103.25 -30.31 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 O-C-N 121.634 -0.667 . . . . 0.0 112.693 -177.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.41 -39.51 32.96 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.265 1.426 . . . . 0.0 112.498 -172.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -53.49 -49.82 66.69 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.272 1.029 . . . . 0.0 111.823 173.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -70.37 -42.25 72.05 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.006 1.322 . . . . 0.0 111.666 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.93 -52.87 61.37 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.843 0.857 . . . . 0.0 111.983 -177.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.13 -33.23 75.01 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 123.433 0.693 . . . . 0.0 111.087 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.4 mtp85 -59.91 -43.0 95.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.053 0.388 . . . . 0.0 110.887 175.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.94 -32.73 71.15 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.157 0.983 . . . . 0.0 111.939 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -64.45 -39.43 93.8 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.464 -1.398 . . . . 0.0 112.918 169.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.5 t -68.35 -14.37 62.94 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 175.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -115.53 15.99 16.61 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 115.853 1.797 . . . . 0.0 115.853 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.85 38.51 0.93 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.465 1.506 . . . . 0.0 113.162 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 6.6 mp -121.22 -32.26 3.93 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.507 1.523 . . . . 0.0 113.391 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.472 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -126.8 163.42 23.61 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.163 0.892 . . . . 0.0 113.057 175.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -148.35 117.45 6.82 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.007 1.723 . . . . 0.0 109.187 176.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -85.31 143.03 28.93 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.98 -0.45 . . . . 0.0 111.416 173.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -87.1 131.04 34.26 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.966 1.306 . . . . 0.0 109.413 170.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -70.96 -14.59 62.42 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.977 0.911 . . . . 0.0 112.365 175.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -83.33 -40.79 19.02 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.659 0.783 . . . . 0.0 112.604 -170.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.2 t -138.93 15.21 2.66 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.506 1.122 . . . . 0.0 113.703 178.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? 53.1 40.65 31.57 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.404 1.481 . . . . 0.0 112.813 -174.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.52 119.13 24.82 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.453 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -84.68 124.87 31.98 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.59 1.156 . . . . 0.0 110.925 175.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.0 OUTLIER -130.83 129.2 42.05 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.58 1.552 . . . . 0.0 108.542 -174.277 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.56 127.82 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 O-C-N 120.707 -1.245 . . . . 0.0 110.788 179.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -66.88 91.65 0.21 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.771 1.228 . . . . 0.0 112.41 -176.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 . . . . . 0 C--O 1.255 1.358 0 C-N-CA 128.484 2.713 . . . . 0.0 113.379 176.146 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 111.984 0.365 . . . . 0.0 111.984 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.451 ' CG ' ' H ' ' A' ' 100' ' ' MET . 19.3 t-80 -134.4 -171.09 2.67 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.193 1.397 . . . . 0.0 111.688 177.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.451 ' H ' ' CG ' ' A' ' 99' ' ' HIS . 66.2 mtt -66.65 153.51 42.93 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.479 1.512 . . . . 0.0 113.211 -174.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.28 20.86 2.61 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.38 1.472 . . . . 0.0 113.88 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 45.3 m -156.08 153.42 25.52 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 126.238 1.815 . . . . 0.0 110.888 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -74.97 175.54 11.09 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.563 2.842 . . . . 0.0 113.158 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -123.56 112.79 17.87 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.271 1.828 . . . . 0.0 108.332 169.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -79.33 148.64 32.0 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -169.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 6.2 t -76.88 -34.37 57.77 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 176.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -150.74 166.64 29.8 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 177.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -45.14 -44.78 10.92 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 126.569 1.948 . . . . 0.0 113.26 176.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -62.64 -40.08 95.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -64.59 -42.71 95.42 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.173 0.989 . . . . 0.0 110.311 -177.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -62.53 -49.4 75.5 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.953 0.901 . . . . 0.0 112.002 171.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.54 -45.95 84.47 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.822 0.849 . . . . 0.0 112.52 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 140' ' ' VAL . 29.3 mt -59.84 -50.18 81.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.213 1.005 . . . . 0.0 110.86 179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -64.71 -48.33 75.05 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.842 0.457 . . . . 0.0 110.813 -177.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.4 tpt85 -58.7 -44.58 90.36 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.924 1.29 . . . . 0.0 112.773 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.93 -52.99 62.7 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.678 1.191 . . . . 0.0 111.55 176.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.77 -19.33 63.51 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.99 -1.069 . . . . 0.0 112.648 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -72.89 -34.74 66.87 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.443 0.697 . . . . 0.0 110.82 169.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -79.81 -41.38 26.57 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.216 0.607 . . . . 0.0 112.098 -173.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -27.95 12.37 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.41 -167.43 24.78 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 110.316 -1.113 . . . . 0.0 110.316 -171.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -64.86 127.74 19.3 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.68 2.92 . . . . 0.0 114.322 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 64.7 mm-40 -139.42 163.25 33.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.446 1.499 . . . . 0.0 110.889 -179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.3 mtt180 -81.14 162.31 23.72 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 120.172 -1.58 . . . . 0.0 112.46 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.516 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.05 -32.04 63.7 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.364 0.666 . . . . 0.0 112.649 -178.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.55 -41.14 89.11 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 121.939 -0.475 . . . . 0.0 111.41 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.1 t -58.86 -45.38 91.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.976 0.511 . . . . 0.0 109.768 173.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.516 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -64.0 -42.65 96.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.629 0.772 . . . . 0.0 110.686 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.467 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.96 -54.44 44.79 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 124.713 1.205 . . . . 0.0 110.002 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -64.28 -33.85 76.77 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.222 0.609 . . . . 0.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.74 -24.77 63.59 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.094 0.775 . . . . 0.0 113.094 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 3.2 mt -89.66 -11.94 41.03 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.351 1.46 . . . . 0.0 113.118 169.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.93 11.05 60.68 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 124.781 1.181 . . . . 0.0 114.136 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.06 174.98 10.36 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.915 1.686 . . . . 0.0 110.803 172.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -107.79 -33.97 7.1 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.3 p -133.42 156.25 48.04 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.587 1.155 . . . . 0.0 112.239 -171.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.13 -27.94 66.08 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.376 1.07 . . . . 0.0 113.581 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.46 -26.38 65.47 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.982 1.313 . . . . 0.0 113.702 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -69.04 -24.1 64.14 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.424 0.556 . . . . 0.0 111.345 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.533 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.25 -30.95 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 123.868 0.867 . . . . 0.0 112.659 -174.765 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.99 -41.1 15.71 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 125.325 1.45 . . . . 0.0 112.408 -175.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -54.17 -44.08 71.18 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.541 1.137 . . . . 0.0 112.9 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.02 -43.17 55.24 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.628 1.171 . . . . 0.0 112.135 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -62.45 -51.81 66.04 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.72 0.808 . . . . 0.0 112.313 -176.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.06 -34.4 77.59 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.669 0.788 . . . . 0.0 110.903 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 2.4 mtm105 -61.39 -44.16 97.62 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.007 0.367 . . . . 0.0 110.595 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.76 -34.56 78.61 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 123.907 0.883 . . . . 0.0 111.394 177.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.8 tttp -65.29 -37.64 87.77 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.849 -1.157 . . . . 0.0 113.503 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.67 -18.52 63.57 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -113.72 15.71 18.71 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.313 1.597 . . . . 0.0 115.313 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.8 t60 71.32 39.22 0.96 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.451 1.501 . . . . 0.0 113.965 174.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.96 -32.11 3.79 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.228 1.811 . . . . 0.0 113.246 -178.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.444 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.7 mt -129.31 164.28 23.87 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.417 1.008 . . . . 0.0 113.47 176.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -148.85 118.23 6.9 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.52 1.928 . . . . 0.0 109.505 175.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.0 ttp -87.67 142.48 27.8 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 120.964 -1.085 . . . . 0.0 112.154 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -106.01 116.12 31.39 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 126.193 1.797 . . . . 0.0 108.001 177.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.42 -6.92 39.17 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.916 0.887 . . . . 0.0 112.693 -177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 28.7 mp0 -69.44 -33.78 73.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.407 1.883 . . . . 0.0 112.444 178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 4.4 t -148.83 14.53 0.93 Allowed 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.059 1.344 . . . . 0.0 113.059 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 51.35 35.88 14.99 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 127.68 2.392 . . . . 0.0 113.28 -169.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.45 119.55 25.93 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.677 0.791 . . . . 0.0 110.35 -174.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.1 m95 -82.3 121.75 27.06 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.926 1.29 . . . . 0.0 111.091 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.75 133.6 54.92 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.164 1.786 . . . . 0.0 109.506 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.35 127.41 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.451 -1.406 . . . . 0.0 110.476 174.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.43 92.75 0.21 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.646 1.179 . . . . 0.0 111.838 -177.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.274 0 C-N-CA 127.539 2.336 . . . . 0.0 112.001 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.4 m . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.0 p-80 -143.1 172.65 12.43 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.226 -178.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 77.7 mtm -123.95 149.58 45.78 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.192 1.397 . . . . 0.0 111.806 177.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.47 51.74 2.31 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.192 1.397 . . . . 0.0 113.247 -173.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 22.6 t -145.75 135.83 11.87 Favored Pre-proline 0 N--CA 1.474 0.743 0 C-N-CA 125.15 1.38 . . . . 0.0 111.191 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -78.36 169.79 19.52 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.539 2.826 . . . . 0.0 113.041 -177.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -124.26 110.27 14.42 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.263 1.825 . . . . 0.0 109.167 169.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.2 m-85 -76.31 140.5 41.52 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 -172.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 4.0 m -76.85 -31.81 57.11 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.709 0.803 . . . . 0.0 112.874 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -153.31 166.84 31.34 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.346 1.858 . . . . 0.0 110.349 175.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.82 -27.95 69.67 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -172.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -59.61 -41.33 90.12 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.873 0.761 . . . . 0.0 112.192 171.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -64.27 -39.13 93.3 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.777 0.831 . . . . 0.0 109.699 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -65.15 -51.7 59.58 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 122.972 0.509 . . . . 0.0 111.909 169.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.27 88.84 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.698 0.681 . . . . 0.0 111.891 -178.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.51 HD11 HG12 ' A' ' 140' ' ' VAL . 30.2 mt -58.34 -53.47 45.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.174 0.99 . . . . 0.0 110.643 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -61.42 -48.66 80.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.876 0.369 . . . . 0.0 111.256 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -64.32 -42.88 96.08 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.572 1.549 . . . . 0.0 112.427 -178.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -60.57 -45.04 95.39 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.793 0.837 . . . . 0.0 112.4 174.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.409 ' CD1' HD21 ' A' ' 153' ' ' LEU . 82.7 mt -75.25 -25.5 58.11 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 121.355 -0.841 . . . . 0.0 112.725 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 76.3 tttt -69.12 -40.88 78.04 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.275 1.03 . . . . 0.0 110.4 169.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -75.39 -42.37 53.97 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -109.33 -16.98 13.91 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -173.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 100.89 -168.32 20.26 Favored Glycine 0 N--CA 1.466 0.67 0 C-N-CA 125.101 1.334 . . . . 0.0 110.557 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -63.09 127.37 20.07 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.757 2.305 . . . . 0.0 112.004 178.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -136.77 163.35 30.83 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.686 1.194 . . . . 0.0 110.712 176.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.4 mtt85 -80.79 160.48 24.85 Favored 'General case' 0 N--CA 1.482 1.133 0 O-C-N 120.194 -1.566 . . . . 0.0 111.726 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.528 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.94 -31.99 63.42 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -176.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.5 tp -65.62 -42.06 92.0 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 122.709 0.404 . . . . 0.0 111.31 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.27 -45.18 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.07 0.548 . . . . 0.0 109.575 174.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.528 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -63.38 -42.22 95.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 123.603 0.761 . . . . 0.0 110.542 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.452 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.44 -54.27 45.85 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.601 1.16 . . . . 0.0 109.827 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -65.64 -33.5 76.05 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.051 0.54 . . . . 0.0 112.138 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.27 -24.41 64.88 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.674 0.789 . . . . 0.0 112.87 176.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.41 HD11 HG13 ' A' ' 113' ' ' ILE . 3.2 mt -90.96 -11.96 37.4 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.064 1.745 . . . . 0.0 113.472 170.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.16 10.88 61.94 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.696 1.141 . . . . 0.0 114.307 -177.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.24 175.72 9.7 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.017 1.727 . . . . 0.0 110.807 172.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -106.48 -35.01 7.21 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -171.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -134.16 156.99 47.35 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.431 1.092 . . . . 0.0 112.445 -170.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.5 -27.32 64.35 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.423 1.089 . . . . 0.0 113.7 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.42 -22.57 61.83 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.679 1.591 . . . . 0.0 114.129 176.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -70.86 -25.83 62.99 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.693 0.678 . . . . 0.0 111.14 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.51 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -104.85 -31.47 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.986 0.914 . . . . 0.0 112.692 -173.054 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -46.71 -38.23 9.6 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.559 1.544 . . . . 0.0 113.224 -175.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.38 -50.07 70.69 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.284 1.433 . . . . 0.0 112.107 174.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . 0.413 ' HB3' HD12 ' A' ' 113' ' ' ILE . 8.9 m-20 -70.1 -41.29 74.22 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.828 1.251 . . . . 0.0 111.601 176.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -64.07 -53.35 51.16 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.332 0.653 . . . . 0.0 112.276 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.4 -31.72 72.13 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.647 0.779 . . . . 0.0 111.106 177.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -60.16 -47.77 84.55 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.184 0.447 . . . . 0.0 110.489 172.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.3 mtp -64.9 -34.32 78.12 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.198 0.999 . . . . 0.0 111.368 179.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -63.77 -40.57 97.01 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.868 -1.145 . . . . 0.0 113.038 170.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.5 m -72.24 -13.74 61.6 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 178.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -113.91 14.98 18.62 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 174.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 72.02 39.21 0.83 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.541 1.537 . . . . 0.0 114.038 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.38 -31.57 3.78 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.118 1.767 . . . . 0.0 113.366 -178.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.477 HD11 ' CG2' ' A' ' 113' ' ' ILE . 12.5 mt -128.77 163.66 24.7 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.71 1.141 . . . . 0.0 113.967 176.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -148.08 121.59 9.12 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.367 1.867 . . . . 0.0 109.424 175.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 46.6 ttp -90.35 145.81 24.67 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.293 -0.88 . . . . 0.0 112.427 173.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -93.23 128.32 39.16 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.162 1.385 . . . . 0.0 109.053 170.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.64 -14.47 62.49 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 121.19 -0.944 . . . . 0.0 112.295 177.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -80.58 -38.53 29.29 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.69 1.196 . . . . 0.0 113.151 -169.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -138.6 14.73 2.73 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.27 1.028 . . . . 0.0 113.084 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.668 1.987 . . . . 0.0 113.181 -174.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -90.05 119.61 30.55 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.069 0.948 . . . . 0.0 110.457 -176.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -87.67 118.32 27.08 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.634 1.574 . . . . 0.0 111.631 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -117.67 136.64 53.19 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 126.442 1.897 . . . . 0.0 112.012 172.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . 0.409 HG12 ' H ' ' A' ' 164' ' ' ILE . 0.4 OUTLIER -54.32 127.37 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.314 1.446 . . . . 0.0 111.084 174.02 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -66.41 89.6 0.14 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.092 1.357 . . . . 0.0 112.523 -176.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 . . . . . 0 C--O 1.254 1.3 0 C-N-CA 128.041 2.536 . . . . 0.0 112.565 176.797 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 111.822 0.304 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.7 p-80 -76.98 160.94 28.75 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.486 1.115 . . . . 0.0 112.569 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 14.8 tpt -86.94 129.34 34.92 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.951 0.9 . . . . 0.0 111.259 174.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -153.47 134.65 14.09 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.99 1.316 . . . . 0.0 111.587 172.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.0 p -159.98 153.89 19.53 Favored Pre-proline 0 N--CA 1.474 0.752 0 C-N-CA 125.559 1.543 . . . . 0.0 111.618 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -77.14 168.83 22.55 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.106 2.537 . . . . 0.0 111.751 170.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -124.4 109.13 12.92 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.489 1.515 . . . . 0.0 109.679 169.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -78.78 147.91 33.13 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -171.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 1.3 m -79.3 -35.91 40.47 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -153.52 163.26 40.26 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.156 1.783 . . . . 0.0 110.738 -176.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.91 -25.22 68.05 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -172.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -63.63 -42.47 98.17 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 118.761 0.709 . . . . 0.0 111.302 173.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.38 -42.88 96.77 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.899 0.88 . . . . 0.0 110.952 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -51.23 64.48 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.634 0.774 . . . . 0.0 111.961 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.57 -41.11 93.94 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.408 0.683 . . . . 0.0 112.404 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.508 HG13 HD11 ' A' ' 132' ' ' LEU . 53.7 mt -58.8 -51.91 66.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 C-N-CA 124.679 1.192 . . . . 0.0 111.048 175.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -61.7 -50.62 71.74 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.16 0.584 . . . . 0.0 110.888 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -61.92 -41.82 98.37 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.909 1.684 . . . . 0.0 112.238 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -59.89 -54.45 46.08 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.434 1.094 . . . . 0.0 111.496 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.95 -19.23 63.38 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.647 -1.283 . . . . 0.0 113.178 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 65.5 tttt -73.56 -36.26 65.59 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.988 0.915 . . . . 0.0 111.361 169.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -83.24 -39.53 20.77 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.261 0.624 . . . . 0.0 112.34 -173.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.32 -28.92 13.08 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 177.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -167.19 23.8 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -172.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.4 ' HB3' HG22 ' A' ' 163' ' ' THR . 56.4 Cg_endo -64.29 126.71 17.56 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 124.091 3.194 . . . . 0.0 114.262 -169.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -140.58 163.01 34.0 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.437 1.495 . . . . 0.0 111.274 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -79.56 161.87 25.7 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 120.058 -1.651 . . . . 0.0 112.561 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.527 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.48 -33.46 63.7 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.47 0.708 . . . . 0.0 112.249 -179.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -64.99 -41.79 95.09 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.023 -0.423 . . . . 0.0 111.289 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 28.4 t -59.45 -45.27 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.16 0.584 . . . . 0.0 109.856 174.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.527 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -62.47 -43.79 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 123.952 0.901 . . . . 0.0 110.43 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.507 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.33 -53.72 54.94 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.615 1.166 . . . . 0.0 110.015 -177.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -63.52 -34.0 76.81 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.2 0.6 . . . . 0.0 112.071 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.96 -25.58 64.62 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.508 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -87.93 -11.91 46.2 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.781 1.632 . . . . 0.0 112.998 169.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.05 11.29 57.75 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.894 1.235 . . . . 0.0 114.26 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 31.5 mtt -81.47 176.88 9.32 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.441 1.896 . . . . 0.0 111.414 174.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -108.23 -31.91 7.7 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 68.4 p -134.85 155.02 51.38 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.551 1.14 . . . . 0.0 112.492 -169.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.02 -26.04 65.77 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.224 1.009 . . . . 0.0 113.667 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -68.4 -27.64 66.39 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.654 1.182 . . . . 0.0 113.679 176.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -70.28 -23.19 62.83 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.044 0.45 . . . . 0.0 111.431 177.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.507 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -102.05 -31.37 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 O-C-N 121.212 -0.93 . . . . 0.0 112.666 -177.589 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.62 -40.87 20.64 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.51 1.524 . . . . 0.0 112.539 -173.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -42.38 71.74 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.833 1.253 . . . . 0.0 113.165 175.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -78.12 -42.08 33.04 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.83 0.852 . . . . 0.0 112.216 174.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.5 -52.39 65.41 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.84 0.856 . . . . 0.0 112.398 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -35.01 79.27 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.409 0.684 . . . . 0.0 110.973 179.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.2 mtp-105 -60.77 -45.44 94.32 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 119.286 -0.388 . . . . 0.0 110.411 175.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.58 -35.63 81.62 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.32 1.048 . . . . 0.0 111.548 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -64.31 -38.52 91.32 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 120.839 -1.163 . . . . 0.0 113.529 171.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.1 t -69.72 -17.9 63.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 174.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -113.83 15.3 18.67 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.84 38.52 0.93 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.561 1.544 . . . . 0.0 113.613 175.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.47 -32.04 3.92 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.946 1.698 . . . . 0.0 113.343 -178.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -127.35 163.94 22.89 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 119.386 0.993 . . . . 0.0 113.275 175.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -148.34 115.33 6.1 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.167 2.187 . . . . 0.0 108.988 178.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.8 ttp -87.97 143.97 26.81 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.493 -0.754 . . . . 0.0 111.679 174.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.91 124.77 45.58 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 125.15 1.38 . . . . 0.0 110.265 175.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.69 -5.79 40.0 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.21 -0.931 . . . . 0.0 113.03 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -83.51 -33.65 25.49 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.729 1.212 . . . . 0.0 112.731 -176.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.3 t -143.96 10.75 1.56 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.879 1.272 . . . . 0.0 113.336 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.3 mmmt 52.81 36.75 22.2 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 127.388 2.275 . . . . 0.0 113.439 -169.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.94 119.35 27.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.614 0.766 . . . . 0.0 110.101 -174.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.98 122.53 27.9 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 124.72 1.208 . . . . 0.0 110.857 172.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.4 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.6 OUTLIER -126.14 130.61 51.37 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.145 1.778 . . . . 0.0 108.673 -178.077 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.37 127.81 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 O-C-N 120.747 -1.221 . . . . 0.0 110.506 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -67.99 89.17 0.29 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.922 1.289 . . . . 0.0 111.886 -177.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? . . . . . 0 C--O 1.251 1.174 0 C-N-CA 127.358 2.263 . . . . 0.0 111.297 -179.226 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.2 m . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 34.6 t60 60.42 170.7 0.09 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.941 2.096 . . . . 0.0 114.982 -175.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 65.6 mtt -71.25 160.36 32.97 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.899 1.679 . . . . 0.0 112.58 178.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -84.03 6.08 23.44 Favored 'General case' 0 CA--C 1.551 1.005 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.0 m -129.81 151.06 77.53 Favored Pre-proline 0 N--CA 1.475 0.818 0 C-N-CA 126.407 1.883 . . . . 0.0 111.41 -177.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -76.14 172.23 16.65 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.364 2.709 . . . . 0.0 112.936 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -123.95 119.98 31.16 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.133 1.773 . . . . 0.0 108.945 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -82.01 145.52 30.19 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -169.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 44.6 m -70.53 -34.38 72.21 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.087 0.955 . . . . 0.0 113.139 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -157.05 170.55 22.27 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 125.763 1.625 . . . . 0.0 110.947 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.64 -24.62 66.84 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.1 mtt180 -66.16 -47.14 75.0 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.191 0.905 . . . . 0.0 111.049 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -55.92 -47.92 76.64 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.833 0.742 . . . . 0.0 111.728 173.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -58.13 -50.56 73.06 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.434 0.693 . . . . 0.0 112.467 177.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.65 -42.72 99.76 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.816 -0.611 . . . . 0.0 112.318 176.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.493 HG13 HD11 ' A' ' 132' ' ' LEU . 48.9 mt -56.41 -51.49 63.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.156 0.982 . . . . 0.0 111.148 177.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.7 t80 -65.13 -50.44 66.0 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.31 0.644 . . . . 0.0 110.593 -175.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 -55.51 -49.1 73.48 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.73 1.212 . . . . 0.0 112.157 176.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -56.18 -53.91 51.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.03 0.932 . . . . 0.0 111.455 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.4 mt -70.77 -19.63 62.69 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 120.802 -1.187 . . . . 0.0 112.944 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.59 -37.4 68.16 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 118.915 0.78 . . . . 0.0 110.895 169.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -81.22 -39.52 25.25 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.16 -28.22 13.13 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.13 -167.84 25.41 Favored Glycine 0 N--CA 1.471 0.97 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 -171.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -64.55 128.38 21.08 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.761 2.974 . . . . 0.0 114.103 -169.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.9 mm-40 -140.29 162.79 34.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.366 1.466 . . . . 0.0 110.662 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 49.2 mtt180 -81.32 161.4 23.87 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 120.159 -1.588 . . . . 0.0 112.008 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.532 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.02 -31.93 63.54 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.052 0.541 . . . . 0.0 112.326 -177.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.2 tp -65.16 -42.0 94.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.948 -0.47 . . . . 0.0 111.219 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.6 t -59.0 -44.99 92.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.055 0.542 . . . . 0.0 109.803 173.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.532 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -63.88 -43.6 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.745 0.818 . . . . 0.0 110.78 -179.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.405 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.08 -54.22 45.93 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.131 1.372 . . . . 0.0 110.153 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -64.17 -34.21 77.56 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 122.972 0.509 . . . . 0.0 111.964 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.99 -25.92 64.76 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.493 HD11 HG13 ' A' ' 113' ' ' ILE . 2.8 mt -86.68 -11.96 49.75 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.684 1.594 . . . . 0.0 113.134 169.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.37 11.67 60.72 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.708 1.147 . . . . 0.0 113.901 -178.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.0 mmt -85.64 175.69 8.61 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.448 1.899 . . . . 0.0 111.004 174.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -107.94 -36.58 6.32 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -173.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.7 p -127.12 155.7 42.92 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.598 1.159 . . . . 0.0 112.403 -171.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.28 -24.64 66.54 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.508 1.123 . . . . 0.0 113.265 175.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -67.4 -28.16 67.68 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.02 1.328 . . . . 0.0 113.402 174.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -71.74 -15.42 62.19 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.268 0.627 . . . . 0.0 112.479 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.413 HG12 HD11 ' A' ' 113' ' ' ILE . 0.1 OUTLIER -113.59 -31.09 2.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.427 1.091 . . . . 0.0 113.062 -179.731 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.32 -41.99 40.19 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.878 1.271 . . . . 0.0 112.213 -175.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 -55.33 -37.72 67.79 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.44 1.096 . . . . 0.0 113.215 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -81.16 -45.51 16.28 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.289 1.036 . . . . 0.0 111.558 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.5 mt -58.57 -52.51 65.37 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.327 -178.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.57 -34.48 77.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.036 0.934 . . . . 0.0 111.033 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.7 mtp-105 -64.28 -45.02 89.83 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.279 174.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.96 -35.36 79.9 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.14 0.976 . . . . 0.0 110.801 177.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -63.4 -40.17 96.5 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.8 -1.188 . . . . 0.0 112.996 170.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 43.2 m -73.96 -13.82 60.94 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.568 1.147 . . . . 0.0 114.032 178.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -113.85 15.42 18.61 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 125.753 1.621 . . . . 0.0 115.04 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 72.43 39.05 0.76 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.584 1.554 . . . . 0.0 114.178 175.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -122.82 -31.87 3.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.184 1.794 . . . . 0.0 113.371 -177.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.418 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -128.87 166.24 19.47 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.575 1.08 . . . . 0.0 113.732 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -149.17 119.43 7.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.322 1.849 . . . . 0.0 109.556 173.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.7 ttp -86.75 144.27 27.15 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 121.208 -0.932 . . . . 0.0 111.922 173.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -86.94 130.98 34.23 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.943 1.297 . . . . 0.0 109.813 171.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.06 -10.4 59.73 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 124.637 1.175 . . . . 0.0 112.957 173.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -87.99 -38.53 15.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.409 0.684 . . . . 0.0 112.758 -171.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.6 t -143.74 18.9 1.83 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.176 0.99 . . . . 0.0 113.656 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.78 39.3 28.5 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 126.303 1.841 . . . . 0.0 113.512 -175.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.6 118.3 25.02 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.935 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -82.92 124.32 30.24 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.519 1.128 . . . . 0.0 110.725 175.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.74 133.13 50.94 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.792 1.637 . . . . 0.0 108.869 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -53.33 131.61 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.564 1.146 . . . . 0.0 110.743 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -67.87 98.01 0.7 Allowed 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 121.946 0.879 . . . . 0.0 111.212 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 50.4 mtm180 . . . . . 0 C--O 1.254 1.294 0 C-N-CA 127.215 2.206 . . . . 0.0 112.108 -176.819 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.2 m . . . . . 0 N--CA 1.488 1.458 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -128.73 151.62 49.34 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.359 1.463 . . . . 0.0 111.798 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -104.1 86.86 2.64 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.806 1.242 . . . . 0.0 110.783 -174.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.05 -3.58 49.17 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 36.5 m -161.92 154.26 16.54 Favored Pre-proline 0 N--CA 1.474 0.758 0 C-N-CA 127.815 2.446 . . . . 0.0 110.061 171.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -75.32 173.41 14.55 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.332 2.688 . . . . 0.0 112.525 175.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -123.9 111.78 16.47 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.972 1.709 . . . . 0.0 109.286 171.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -78.62 146.63 34.01 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -169.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.5 t -75.04 -35.5 61.9 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.114 0.965 . . . . 0.0 112.414 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -153.06 171.28 18.64 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.012 1.325 . . . . 0.0 112.351 176.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.47 -32.65 58.13 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.797 1.239 . . . . 0.0 113.234 178.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 71.8 mtt180 -66.68 -49.72 65.19 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.209 0.913 . . . . 0.0 111.567 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -54.06 -48.16 70.88 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.138 0.881 . . . . 0.0 111.915 174.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -55.26 -52.1 64.5 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.313 1.045 . . . . 0.0 112.588 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.23 -38.44 85.24 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 118.531 -0.747 . . . . 0.0 112.377 179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.47 HG13 HD11 ' A' ' 132' ' ' LEU . 44.3 mt -57.33 -50.42 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 119.287 0.949 . . . . 0.0 110.873 178.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -63.84 -51.36 65.02 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.329 0.652 . . . . 0.0 110.694 -178.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 ttp180 -57.95 -43.96 86.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.09 1.356 . . . . 0.0 112.921 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -59.66 -53.69 55.1 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.297 1.039 . . . . 0.0 111.422 174.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.7 mt -70.68 -18.96 62.82 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.827 -1.171 . . . . 0.0 113.04 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -73.48 -36.36 65.8 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.696 0.799 . . . . 0.0 110.891 169.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.64 -38.55 23.37 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.28 0.632 . . . . 0.0 112.378 -172.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.17 -27.7 13.08 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 95.81 -167.7 25.76 Favored Glycine 0 CA--C 1.529 0.929 0 N-CA-C 110.518 -1.033 . . . . 0.0 110.518 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.432 ' HB3' HG22 ' A' ' 163' ' ' THR . 49.7 Cg_endo -63.76 127.76 20.43 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 124.05 3.167 . . . . 0.0 114.228 -169.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -141.3 162.36 35.68 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.401 1.48 . . . . 0.0 111.281 -179.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 -80.57 161.38 24.8 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 120.159 -1.588 . . . . 0.0 112.298 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.539 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.82 -32.33 63.47 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.19 0.596 . . . . 0.0 112.428 -177.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 27.3 tp -66.38 -39.98 89.42 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.832 -0.543 . . . . 0.0 111.347 178.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 32.4 t -59.88 -45.7 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 122.927 0.491 . . . . 0.0 109.676 173.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.539 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -63.16 -43.38 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.93 0.892 . . . . 0.0 110.688 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -55.58 -55.11 35.85 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.203 1.401 . . . . 0.0 110.15 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -64.67 -33.95 77.14 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.939 0.496 . . . . 0.0 111.925 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.85 -26.79 65.33 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 177.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.47 HD11 HG13 ' A' ' 113' ' ' ILE . 3.5 mt -85.96 -12.01 51.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.363 1.465 . . . . 0.0 113.036 169.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.92 10.6 59.78 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.803 1.192 . . . . 0.0 113.937 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 13.3 mmt -83.44 176.81 8.8 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.402 1.881 . . . . 0.0 111.109 175.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 88.3 mmt-85 -108.14 -31.06 8.07 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -174.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 66.5 p -135.58 156.56 48.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.337 1.055 . . . . 0.0 112.335 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.17 -25.18 66.84 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.646 1.178 . . . . 0.0 113.371 176.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.04 -27.48 66.56 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.267 1.427 . . . . 0.0 113.476 174.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -71.89 -15.33 62.11 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.384 0.673 . . . . 0.0 112.258 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.446 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -114.54 -31.56 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 124.398 1.079 . . . . 0.0 113.061 -179.418 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -48.29 -40.72 25.83 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.056 1.343 . . . . 0.0 112.729 -174.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -55.82 -44.38 77.86 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.727 1.211 . . . . 0.0 112.683 175.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -74.22 -43.02 58.79 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.653 1.181 . . . . 0.0 111.849 175.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.97 -52.43 65.03 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.124 0.97 . . . . 0.0 112.131 -176.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.11 79.39 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.304 0.641 . . . . 0.0 110.768 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 -64.3 -42.06 96.54 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 118.523 -0.751 . . . . 0.0 110.857 176.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -64.33 -34.91 79.22 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.187 0.995 . . . . 0.0 111.411 175.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -64.98 -38.26 90.39 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.791 -1.193 . . . . 0.0 113.232 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.8 t -69.58 -17.49 63.55 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 174.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -113.73 15.2 18.8 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.49 38.68 0.98 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.6 1.56 . . . . 0.0 113.824 175.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.8 mp -120.63 -32.67 3.99 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.008 1.723 . . . . 0.0 112.959 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.447 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -129.11 164.29 23.63 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 177.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -149.3 115.38 5.74 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.274 1.83 . . . . 0.0 109.603 176.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.3 ttp -84.0 145.15 28.67 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 111.802 174.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -91.11 130.36 37.01 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.049 1.339 . . . . 0.0 109.815 171.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.66 -9.22 58.44 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 124.084 0.954 . . . . 0.0 113.05 173.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -87.45 -36.67 17.57 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.564 0.746 . . . . 0.0 112.865 -172.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.1 t -143.62 18.01 1.84 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.222 1.009 . . . . 0.0 113.551 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 52.39 40.0 28.58 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 126.813 2.045 . . . . 0.0 113.826 -175.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.74 119.74 27.29 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.426 0.691 . . . . 0.0 109.79 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -82.96 125.15 31.07 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.773 1.229 . . . . 0.0 110.953 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.432 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.2 p -130.58 128.29 40.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.234 1.414 . . . . 0.0 108.594 -173.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.62 129.16 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 120.597 -1.315 . . . . 0.0 110.947 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.33 89.25 0.33 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.689 1.195 . . . . 0.0 112.216 -177.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 . . . . . 0 C--O 1.253 1.239 0 C-N-CA 127.204 2.202 . . . . 0.0 112.012 178.018 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.9 m . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 112.405 0.521 . . . . 0.0 112.405 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -80.36 152.53 28.86 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 119.121 0.873 . . . . 0.0 112.181 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -78.48 131.74 36.98 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.328 0.651 . . . . 0.0 110.427 173.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -146.93 171.11 15.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.318 1.447 . . . . 0.0 111.887 -177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 29.0 p -61.57 143.93 93.07 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 123.905 0.882 . . . . 0.0 112.718 176.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -74.22 177.57 8.09 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 124.068 3.179 . . . . 0.0 113.338 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -118.38 115.74 25.29 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.833 1.653 . . . . 0.0 108.804 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -81.1 148.27 29.71 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 114.651 1.352 . . . . 0.0 114.651 -169.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 3.6 m -82.55 -31.2 29.2 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.07 0.948 . . . . 0.0 113.26 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -155.12 166.0 34.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.855 1.662 . . . . 0.0 111.254 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -25.39 65.26 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -176.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -72.48 -40.03 67.25 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 118.902 0.774 . . . . 0.0 111.536 176.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.52 -44.8 89.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.91 0.884 . . . . 0.0 110.058 173.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.16 -55.17 31.33 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.835 0.854 . . . . 0.0 113.081 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.82 -40.53 93.11 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 118.769 0.713 . . . . 0.0 112.324 -177.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.485 HD11 HG12 ' A' ' 140' ' ' VAL . 55.5 mt -61.91 -51.87 67.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 119.426 1.012 . . . . 0.0 111.381 178.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -64.02 -48.41 76.47 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.419 0.288 . . . . 0.0 110.782 -177.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 3.7 tpt180 -55.57 -50.53 69.82 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.1 1.36 . . . . 0.0 112.382 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.87 -52.04 65.46 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.922 0.889 . . . . 0.0 111.568 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.5 mt -70.28 -19.79 63.08 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.92 -1.112 . . . . 0.0 112.931 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -73.3 -37.02 66.36 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.904 0.774 . . . . 0.0 111.185 169.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -80.73 -38.39 28.83 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.47 0.545 . . . . 0.0 112.47 -173.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.18 -27.99 12.91 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.04 -168.87 24.85 Favored Glycine 0 CA--C 1.529 0.951 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -172.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.412 ' HB3' HG22 ' A' ' 163' ' ' THR . 45.6 Cg_endo -62.06 128.35 23.85 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.033 3.155 . . . . 0.0 113.888 -171.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.5 mm-40 -141.34 163.94 31.58 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.222 1.409 . . . . 0.0 111.189 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 52.2 mtt85 -81.63 159.98 23.87 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 120.322 -1.486 . . . . 0.0 111.928 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.535 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.66 -32.45 63.23 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.221 0.608 . . . . 0.0 112.535 -177.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.3 tp -65.18 -42.05 94.01 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.792 0.437 . . . . 0.0 111.38 177.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.02 -44.73 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.226 0.61 . . . . 0.0 109.647 174.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.535 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -63.82 -43.49 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.432 0.693 . . . . 0.0 110.853 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.478 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.3 -53.97 49.48 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.052 1.341 . . . . 0.0 110.047 -178.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -63.95 -34.07 77.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.223 0.609 . . . . 0.0 112.022 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.82 -24.58 64.4 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 177.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.478 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -89.99 -11.94 40.12 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.386 1.474 . . . . 0.0 113.168 169.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.04 10.46 61.16 Favored Glycine 0 CA--C 1.537 1.45 0 C-N-CA 125.007 1.289 . . . . 0.0 113.942 -177.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.5 mmt -82.78 173.57 11.75 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.906 1.682 . . . . 0.0 110.684 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -108.03 -30.65 8.33 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -169.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 67.7 p -135.97 155.98 49.45 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.633 1.173 . . . . 0.0 112.012 -172.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.85 -27.65 65.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.31 -25.56 64.29 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.898 1.279 . . . . 0.0 113.721 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.22 -27.48 66.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.272 0.558 . . . . 0.0 111.113 176.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.485 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.52 -31.18 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 123.62 0.768 . . . . 0.0 112.457 -172.969 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.37 -41.0 12.89 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 112.401 -175.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.0 ttp180 -54.2 -44.32 71.51 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.732 1.213 . . . . 0.0 113.261 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.27 -42.64 44.88 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.999 0.92 . . . . 0.0 111.568 175.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.2 mt -61.17 -52.84 63.12 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.923 . . . . 0.0 112.255 -177.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -34.03 77.44 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.783 0.833 . . . . 0.0 111.081 176.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 36.1 mtp85 -58.98 -46.99 86.75 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 119.39 -0.338 . . . . 0.0 110.39 173.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 41.1 mtm -64.28 -34.65 78.6 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.427 0.691 . . . . 0.0 112.274 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 55.0 tttp -65.01 -34.34 78.21 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 169.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.1 t -75.29 -16.27 60.44 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 173.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -114.04 15.23 18.42 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 6.0 t60 71.54 40.0 0.85 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.494 1.518 . . . . 0.0 114.068 175.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.85 -33.13 3.41 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.249 1.82 . . . . 0.0 113.304 -177.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.7 mt -129.51 163.95 24.81 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.737 1.153 . . . . 0.0 113.575 177.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -149.06 117.02 6.31 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.208 1.803 . . . . 0.0 109.772 176.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.0 ttp -85.38 143.66 28.49 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.106 0.562 . . . . 0.0 112.088 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.23 123.59 42.39 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 125.909 1.684 . . . . 0.0 109.688 172.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.25 -5.5 36.35 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.736 0.814 . . . . 0.0 112.876 179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -75.84 -36.25 59.7 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.189 1.395 . . . . 0.0 112.355 -178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -148.2 16.45 1.06 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 176.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.3 mptt 52.69 40.9 31.13 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.501 1.92 . . . . 0.0 113.004 -170.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -81.88 118.79 23.2 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.663 178.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -84.22 124.78 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.929 1.291 . . . . 0.0 110.819 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.412 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.5 p -130.47 127.99 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.173 1.389 . . . . 0.0 108.385 -172.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.47 130.48 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 O-C-N 120.606 -1.309 . . . . 0.0 111.077 -179.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -66.84 96.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 122.221 1.01 . . . . 0.0 111.793 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.806 2.443 . . . . 0.0 110.937 -176.362 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.4 m . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -78.95 163.91 24.85 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.463 1.105 . . . . 0.0 113.065 177.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 16.5 tpt -89.05 135.16 33.7 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.351 1.06 . . . . 0.0 111.513 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -146.05 159.01 43.87 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.398 1.479 . . . . 0.0 111.825 177.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 49.7 m 49.37 60.24 15.77 Favored Pre-proline 0 N--CA 1.478 0.942 0 C-N-CA 125.658 1.583 . . . . 0.0 113.952 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -71.41 172.0 15.06 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 124.0 3.133 . . . . 0.0 112.807 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -124.05 109.47 13.54 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.382 1.473 . . . . 0.0 110.557 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -82.14 147.41 29.06 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.233 1.013 . . . . 0.0 112.251 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 64.9 p -77.81 -33.41 52.47 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -153.65 166.37 33.01 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.895 1.278 . . . . 0.0 111.736 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -46.09 -37.67 7.1 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.081 1.752 . . . . 0.0 113.073 175.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -69.21 -41.22 77.37 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.04 0.836 . . . . 0.0 113.238 -178.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -60.84 -45.73 93.32 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 119.22 0.918 . . . . 0.0 111.108 175.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -58.39 -49.5 77.04 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 174.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -60.17 -43.86 95.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.727 0.811 . . . . 0.0 112.381 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.475 HD11 HG12 ' A' ' 140' ' ' VAL . 34.5 mt -58.59 -50.84 77.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.65 1.18 . . . . 0.0 111.508 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -62.64 -51.49 67.05 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.945 0.498 . . . . 0.0 111.076 178.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -61.22 -39.78 91.53 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.436 1.094 . . . . 0.0 112.344 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.48 -54.24 47.91 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.472 1.109 . . . . 0.0 111.482 173.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.46 -18.87 63.76 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 120.737 -1.227 . . . . 0.0 112.989 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -73.79 -37.15 65.04 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.896 0.878 . . . . 0.0 111.454 169.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -81.67 -38.89 25.18 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.323 0.649 . . . . 0.0 112.278 -173.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.09 -29.16 11.92 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.76 -167.82 23.37 Favored Glycine 0 N--CA 1.469 0.857 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -172.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.455 ' HB3' HG22 ' A' ' 163' ' ' THR . 56.2 Cg_endo -65.23 128.14 19.82 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 123.772 2.981 . . . . 0.0 113.814 -170.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 -139.06 162.66 34.39 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.585 1.554 . . . . 0.0 111.19 -178.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -79.27 158.16 27.61 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 120.196 -1.565 . . . . 0.0 111.05 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.541 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.85 -31.72 59.86 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.262 0.625 . . . . 0.0 112.439 -179.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.6 tp -64.86 -41.32 95.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.165 0.586 . . . . 0.0 111.699 177.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.5 t -60.24 -45.71 95.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 123.565 0.746 . . . . 0.0 109.121 174.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.541 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.52 -43.63 97.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.529 0.732 . . . . 0.0 110.453 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.458 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.19 -55.58 31.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.234 1.414 . . . . 0.0 109.875 -178.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -63.85 -34.63 78.37 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.289 0.636 . . . . 0.0 111.986 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.24 64.28 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.451 HD11 HG13 ' A' ' 113' ' ' ILE . 4.2 mt -89.96 -11.96 40.16 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.488 1.515 . . . . 0.0 113.236 170.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 95.64 5.88 59.87 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.288 1.423 . . . . 0.0 114.248 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 20.4 mmm -80.93 173.77 12.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.557 1.543 . . . . 0.0 110.902 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -106.77 -29.91 9.25 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -170.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.9 p -137.77 156.37 48.04 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.412 1.085 . . . . 0.0 112.206 -171.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.94 -28.66 64.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.345 1.058 . . . . 0.0 113.833 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.74 -25.1 63.67 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.866 1.266 . . . . 0.0 113.705 176.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.23 -28.5 67.29 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.219 0.533 . . . . 0.0 110.915 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.475 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.01 -31.47 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.531 0.732 . . . . 0.0 112.334 -172.663 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.29 -41.64 6.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 126.029 1.732 . . . . 0.0 112.872 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.21 -44.84 75.73 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.621 1.168 . . . . 0.0 112.769 175.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -77.19 -38.7 51.0 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.033 0.933 . . . . 0.0 112.625 175.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.19 -51.4 67.96 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.768 0.827 . . . . 0.0 112.215 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.03 -33.12 75.29 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.969 -0.457 . . . . 0.0 111.005 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 26.7 mtp-105 -64.47 -41.22 96.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 118.366 -0.826 . . . . 0.0 111.355 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.3 mtp -63.86 -37.23 86.64 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.258 0.936 . . . . 0.0 111.997 172.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -64.7 -39.95 94.53 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 120.452 -1.405 . . . . 0.0 112.321 173.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.6 t -67.04 -14.32 62.78 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.231 1.412 . . . . 0.0 114.111 175.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 -113.25 13.23 19.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.547 1.139 . . . . 0.0 114.009 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.6 t60 69.01 39.37 1.79 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.122 1.369 . . . . 0.0 113.087 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -121.71 -34.2 3.45 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.196 1.398 . . . . 0.0 113.478 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.5 mp -119.63 160.35 22.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.799 1.24 . . . . 0.0 112.673 175.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -144.38 115.38 7.86 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.966 1.706 . . . . 0.0 109.87 174.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 44.4 ttp -85.83 144.12 27.89 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.298 0.57 . . . . 0.0 111.979 172.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -105.15 119.93 40.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.862 1.665 . . . . 0.0 107.999 173.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -67.97 -12.47 60.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.906 0.882 . . . . 0.0 113.286 -172.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -77.52 -35.0 53.84 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.428 1.491 . . . . 0.0 112.68 -170.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 11.8 t -135.09 11.79 3.58 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.701 1.2 . . . . 0.0 112.797 171.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm 53.44 38.94 29.17 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 126.128 1.771 . . . . 0.0 112.232 -169.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.82 116.05 19.76 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.344 0.658 . . . . 0.0 109.438 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -81.08 125.37 30.12 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 124.628 1.171 . . . . 0.0 110.533 171.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.455 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.8 OUTLIER -120.04 163.6 17.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 107.621 176.492 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.94 130.03 36.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 120.817 -1.177 . . . . 0.0 109.467 172.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -68.03 89.62 0.3 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.927 1.291 . . . . 0.0 111.539 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 40.4 ptt180 . . . . . 0 C--O 1.255 1.347 0 C-N-CA 127.075 2.15 . . . . 0.0 113.004 178.254 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 10.5 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 120.452 0.168 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -147.06 160.21 42.67 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.692 1.597 . . . . 0.0 112.283 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 93.4 mmm 52.33 41.94 30.76 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.689 1.596 . . . . 0.0 113.985 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.54 161.11 33.37 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.445 1.498 . . . . 0.0 113.154 -174.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 50.4 m -64.08 155.28 79.31 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 125.466 1.506 . . . . 0.0 112.948 177.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.9 171.72 14.1 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.195 2.596 . . . . 0.0 111.957 172.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -124.1 117.69 25.23 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.201 1.4 . . . . 0.0 110.538 174.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -88.44 144.28 26.47 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.064 0.946 . . . . 0.0 111.016 174.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.9 m -78.48 -27.58 46.31 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.982 0.913 . . . . 0.0 112.925 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -158.41 166.85 31.22 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.712 1.605 . . . . 0.0 110.945 177.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -25.52 68.08 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -173.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 59.4 mtt180 -56.06 -47.12 78.53 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 118.774 0.715 . . . . 0.0 111.475 172.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -61.32 -43.14 99.38 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 122.943 0.497 . . . . 0.0 110.809 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -59.44 -48.79 80.3 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 122.003 -0.436 . . . . 0.0 112.091 172.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.565 0.746 . . . . 0.0 112.271 178.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.526 HD11 HG12 ' A' ' 140' ' ' VAL . 25.1 mt -55.89 -51.27 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.985 1.314 . . . . 0.0 111.332 177.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.415 ' CD2' HD12 ' A' ' 152' ' ' LEU . 37.0 t80 -63.49 -51.45 65.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 122.716 0.406 . . . . 0.0 111.025 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -56.49 -41.63 76.93 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.983 1.313 . . . . 0.0 112.67 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -62.75 -53.26 57.02 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.844 1.258 . . . . 0.0 111.49 175.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.9 mt -69.71 -18.71 63.56 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.884 -1.135 . . . . 0.0 112.681 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -73.7 -37.12 65.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 118.938 0.79 . . . . 0.0 111.474 169.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.96 -38.71 27.24 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.384 0.674 . . . . 0.0 112.319 -173.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -28.69 11.4 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 177.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.76 -169.23 25.52 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -63.95 130.24 26.97 Favored 'Trans proline' 0 CA--C 1.536 0.616 0 C-N-CA 123.497 2.798 . . . . 0.0 114.09 -170.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 72.5 mm-40 -139.07 163.56 32.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.604 1.562 . . . . 0.0 110.832 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 58.1 mtt-85 -78.61 157.67 28.65 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 120.21 -1.556 . . . . 0.0 111.106 177.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.504 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -53.26 -33.92 55.09 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.759 0.824 . . . . 0.0 112.524 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.07 -41.26 95.27 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.331 0.652 . . . . 0.0 111.879 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.6 t -59.61 -46.05 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.504 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -60.74 -43.18 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.347 0.659 . . . . 0.0 110.328 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.54 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.5 -54.21 49.44 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.443 1.097 . . . . 0.0 110.024 -177.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -64.86 -33.51 76.18 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.313 0.645 . . . . 0.0 112.119 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.18 -25.13 64.19 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 123.673 0.789 . . . . 0.0 112.962 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.427 HD11 HG13 ' A' ' 113' ' ' ILE . 2.9 mt -89.95 -11.86 40.48 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.678 1.591 . . . . 0.0 113.334 170.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.48 11.48 59.45 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.689 1.138 . . . . 0.0 114.381 -178.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . 0.425 ' HE3' HD13 ' A' ' 132' ' ' LEU . 33.3 mtt -80.32 176.86 9.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.218 1.807 . . . . 0.0 111.116 171.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 86.0 mtt85 -107.69 -36.8 6.32 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -175.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -132.41 157.01 45.65 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.459 1.104 . . . . 0.0 112.506 -170.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.45 -27.51 66.14 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.78 1.029 . . . . 0.0 113.78 176.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -70.58 -23.5 62.6 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.644 1.578 . . . . 0.0 113.986 175.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -71.39 -25.17 62.24 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 118.276 0.489 . . . . 0.0 111.078 174.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.54 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -102.16 -31.45 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.404 0.682 . . . . 0.0 112.634 -175.723 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.38 -38.58 13.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.553 1.541 . . . . 0.0 113.325 -173.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.8 -47.6 76.86 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.668 1.587 . . . . 0.0 112.441 174.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . 0.436 ' HB3' HD12 ' A' ' 113' ' ' ILE . 9.2 m-20 -72.72 -41.1 65.59 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.863 1.265 . . . . 0.0 111.904 176.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.42 -52.14 62.81 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.676 0.79 . . . . 0.0 112.048 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.63 -33.67 76.14 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.844 0.458 . . . . 0.0 110.676 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 59.2 mtt180 -67.58 -39.29 84.87 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.03 177.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.74 -37.26 85.89 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 119.704 1.138 . . . . 0.0 111.924 171.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.1 tttm -64.79 -41.17 96.04 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.645 -1.284 . . . . 0.0 112.194 173.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -66.62 -13.99 61.85 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.994 1.318 . . . . 0.0 114.182 175.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -113.17 13.0 19.18 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.821 1.248 . . . . 0.0 113.972 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.5 t60 69.49 39.32 1.61 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.225 1.41 . . . . 0.0 113.324 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.415 HD12 ' CD2' ' A' ' 114' ' ' TYR . 4.5 mm? -121.47 -34.27 3.47 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.333 1.453 . . . . 0.0 113.153 -178.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.3 mp -119.9 160.76 22.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.931 1.293 . . . . 0.0 113.11 175.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -142.66 115.55 8.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.348 1.859 . . . . 0.0 110.185 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.2 ttp -88.27 143.66 26.9 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.087 -1.008 . . . . 0.0 112.25 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -89.39 130.81 35.7 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.849 1.26 . . . . 0.0 108.342 169.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.52 -14.11 61.16 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 121.09 -1.006 . . . . 0.0 112.536 175.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -85.35 -37.65 19.66 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -169.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -137.17 13.43 3.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.437 1.095 . . . . 0.0 113.148 177.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm 52.52 42.14 31.25 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.221 1.809 . . . . 0.0 113.035 -176.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.13 117.61 25.98 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.903 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -83.98 120.0 25.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.633 1.173 . . . . 0.0 110.639 173.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.22 165.5 11.71 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.811 2.044 . . . . 0.0 108.786 170.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.24 127.65 39.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.471 1.108 . . . . 0.0 109.637 170.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -66.15 88.65 0.12 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.392 1.477 . . . . 0.0 112.027 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 45.8 ttm105 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 127.023 2.129 . . . . 0.0 112.037 178.877 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 37.3 m80 62.34 165.67 0.11 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 127.613 2.365 . . . . 0.0 115.287 -175.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 86.2 mmm 55.09 28.21 10.56 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.089 1.756 . . . . 0.0 114.832 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.54 148.07 27.41 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.489 1.116 . . . . 0.0 113.483 -173.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 62.8 m -86.62 156.54 55.99 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 125.24 1.416 . . . . 0.0 111.936 173.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -68.84 173.95 9.4 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.132 2.555 . . . . 0.0 112.154 169.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -123.7 115.55 21.61 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.891 1.676 . . . . 0.0 108.812 173.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -82.73 147.75 28.27 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -169.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 1.5 m -79.6 -31.75 41.8 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.905 0.882 . . . . 0.0 112.97 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -153.87 164.28 38.64 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.128 1.371 . . . . 0.0 112.452 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -47.94 -42.83 28.35 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.322 1.849 . . . . 0.0 112.945 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 -65.91 -42.05 90.67 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 121.62 -0.675 . . . . 0.0 111.478 -178.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -57.96 -43.8 86.67 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.064 1.346 . . . . 0.0 111.045 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -64.92 -50.92 64.59 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.723 0.809 . . . . 0.0 112.385 176.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.45 -40.21 96.52 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 118.705 -0.664 . . . . 0.0 112.241 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.547 HG13 HD11 ' A' ' 132' ' ' LEU . 51.3 mt -57.91 -51.0 76.0 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 119.502 1.047 . . . . 0.0 110.992 176.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -63.54 -50.81 68.09 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.758 0.423 . . . . 0.0 110.663 -179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -58.96 -42.07 88.98 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.662 1.185 . . . . 0.0 112.963 -179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -61.47 -53.56 54.89 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.813 1.245 . . . . 0.0 111.685 174.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.91 -19.68 64.21 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.987 -1.071 . . . . 0.0 112.618 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -72.99 -37.21 67.08 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.899 0.88 . . . . 0.0 110.892 169.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -76.53 -41.26 47.36 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 122.947 0.499 . . . . 0.0 112.029 -174.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -104.12 -28.14 11.66 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -178.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.36 -168.48 25.53 Favored Glycine 0 N--CA 1.469 0.883 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 -172.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -62.71 128.58 23.72 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.615 2.877 . . . . 0.0 114.155 -170.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.0 mm-40 -138.96 164.21 30.32 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.132 1.373 . . . . 0.0 110.673 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 63.8 mtt85 -80.56 160.22 25.23 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.36 -1.462 . . . . 0.0 111.347 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.53 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.43 -33.07 63.24 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.278 0.631 . . . . 0.0 112.413 -177.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.3 tp -65.56 -39.79 92.07 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.255 0.622 . . . . 0.0 111.636 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.71 -46.3 96.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 174.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.53 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -61.35 -43.06 95.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 C-N-CA 123.26 0.624 . . . . 0.0 110.488 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.517 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.9 -54.31 48.4 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.662 1.185 . . . . 0.0 110.145 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.78 -33.63 76.44 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.209 0.604 . . . . 0.0 112.131 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.87 65.37 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.396 0.678 . . . . 0.0 112.789 177.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.547 HD11 HG13 ' A' ' 113' ' ' ILE . 3.1 mt -88.47 -11.89 44.6 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.746 1.619 . . . . 0.0 113.394 169.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 11.66 60.18 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 124.704 1.145 . . . . 0.0 114.206 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.0 mtt -79.6 176.95 9.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.23 1.812 . . . . 0.0 111.21 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.99 -35.43 6.62 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 70.2 p -133.13 155.73 48.75 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.699 1.2 . . . . 0.0 112.37 -170.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.3 -27.33 65.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.162 0.985 . . . . 0.0 113.655 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -68.35 -26.92 65.84 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -68.79 -25.97 64.97 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.044 0.45 . . . . 0.0 111.241 176.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.517 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -100.68 -31.11 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 O-C-N 121.241 -0.912 . . . . 0.0 112.509 -176.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.67 -41.59 22.77 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.848 1.659 . . . . 0.0 112.216 -174.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -54.67 -41.15 69.82 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.567 1.147 . . . . 0.0 113.12 175.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -78.68 -44.45 23.62 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.559 0.744 . . . . 0.0 111.708 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.28 -52.45 65.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.274 1.029 . . . . 0.0 112.581 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.64 -35.81 81.07 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.758 0.823 . . . . 0.0 111.036 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.9 mtp-105 -62.85 -42.01 99.58 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.796 175.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 87.5 mtp -65.77 -34.39 78.07 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.111 0.964 . . . . 0.0 111.091 176.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.9 tttp -65.12 -37.41 87.34 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 120.998 -1.064 . . . . 0.0 113.399 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.7 t -70.05 -18.04 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 174.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -113.75 15.85 18.64 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.44 38.6 1.0 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.487 1.515 . . . . 0.0 113.947 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.5 mp -121.39 -32.4 3.87 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.966 1.707 . . . . 0.0 113.281 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 12.4 mt -129.08 164.51 23.13 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.491 1.041 . . . . 0.0 113.541 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -147.95 118.55 7.48 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.711 2.004 . . . . 0.0 109.398 175.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.6 ttp -88.35 143.15 27.19 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.132 -0.98 . . . . 0.0 112.083 173.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -87.22 129.69 34.87 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.95 1.3 . . . . 0.0 109.312 170.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -71.1 -13.0 61.81 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 124.029 0.932 . . . . 0.0 112.432 177.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 63.6 mm-40 -83.69 -42.6 16.45 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.121 0.968 . . . . 0.0 112.729 -171.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 21.5 t -136.82 15.48 3.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.545 1.138 . . . . 0.0 113.499 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? 52.26 40.99 30.12 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.553 1.541 . . . . 0.0 112.801 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.15 118.0 24.45 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.637 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -85.03 121.94 28.53 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 124.713 1.205 . . . . 0.0 111.149 177.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.2 133.34 54.23 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.994 1.718 . . . . 0.0 109.559 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -56.81 127.49 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 O-C-N 120.454 -1.404 . . . . 0.0 110.632 176.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -66.8 92.46 0.22 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.694 1.198 . . . . 0.0 111.937 -177.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.272 0 C-N-CA 126.268 1.827 . . . . 0.0 113.826 178.275 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -131.86 158.65 40.78 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.446 1.499 . . . . 0.0 112.251 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.7 mmm -75.28 156.85 35.22 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.159 0.984 . . . . 0.0 111.979 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -136.52 148.66 47.73 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.516 1.126 . . . . 0.0 113.377 -176.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 58.8 p -157.73 158.37 30.35 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.354 2.262 . . . . 0.0 110.231 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -74.18 166.04 30.51 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.405 2.07 . . . . 0.0 111.57 176.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -124.36 112.48 17.0 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.815 1.646 . . . . 0.0 109.437 170.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -67.65 134.02 50.39 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.601 -0.687 . . . . 0.0 110.142 175.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 7.5 m -72.97 -29.35 63.01 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.295 1.038 . . . . 0.0 112.243 -174.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -158.67 168.99 25.39 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.718 2.007 . . . . 0.0 110.689 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -48.04 -35.4 11.06 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.808 1.643 . . . . 0.0 113.337 175.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 24.5 mtm180 -67.47 -39.59 85.3 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -60.88 -45.1 95.89 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.544 1.065 . . . . 0.0 111.062 176.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -60.36 -47.54 85.64 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.537 0.735 . . . . 0.0 111.469 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -63.5 -40.7 97.76 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.826 0.85 . . . . 0.0 113.254 177.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.499 HD11 HG12 ' A' ' 140' ' ' VAL . 30.2 mt -60.87 -50.24 81.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 124.359 1.063 . . . . 0.0 111.591 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -61.33 -51.35 69.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.662 0.267 . . . . 0.0 110.79 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 31.7 ttp180 -58.98 -42.08 89.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.19 1.396 . . . . 0.0 113.23 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -60.63 -53.68 54.54 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.28 1.032 . . . . 0.0 111.329 174.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.2 mt -70.43 -19.6 62.97 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 120.768 -1.208 . . . . 0.0 112.877 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.95 -38.07 69.85 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.554 1.142 . . . . 0.0 111.043 169.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -82.16 -39.55 23.07 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.322 0.649 . . . . 0.0 112.295 -172.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.94 -28.94 12.1 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 177.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.75 -168.19 23.6 Favored Glycine 0 N--CA 1.47 0.946 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -171.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.33 129.12 20.75 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.562 2.841 . . . . 0.0 114.063 -169.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -140.61 161.03 38.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.774 1.629 . . . . 0.0 110.967 -178.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -78.15 161.18 27.54 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 119.786 -1.822 . . . . 0.0 112.428 176.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.547 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.83 -31.67 62.91 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.259 0.624 . . . . 0.0 112.423 -179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -41.15 92.48 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.876 -0.515 . . . . 0.0 111.478 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.7 t -59.46 -46.59 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.003 0.521 . . . . 0.0 109.679 173.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.547 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -61.82 -43.43 97.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.087 0.955 . . . . 0.0 110.232 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.479 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.91 -54.63 44.35 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.904 1.282 . . . . 0.0 110.061 -177.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -64.45 -34.78 79.0 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.161 0.585 . . . . 0.0 112.02 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.29 -25.47 64.26 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.425 HD11 HG13 ' A' ' 113' ' ' ILE . 5.2 mt -89.98 -12.12 39.63 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.554 1.542 . . . . 0.0 113.36 171.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.78 9.95 62.08 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.757 1.17 . . . . 0.0 114.475 -177.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 18.0 mmt -80.63 176.64 9.62 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.34 1.456 . . . . 0.0 110.632 170.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -108.09 -31.64 7.86 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -172.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 58.1 p -136.83 156.96 47.81 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.417 1.087 . . . . 0.0 112.234 -171.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -29.89 65.26 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.337 1.055 . . . . 0.0 113.758 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -69.19 -25.12 64.17 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.849 1.26 . . . . 0.0 113.639 176.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.7 -27.55 66.05 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.193 0.451 . . . . 0.0 110.966 176.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.499 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.8 -31.14 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.503 0.721 . . . . 0.0 112.565 -173.378 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.65 -41.64 6.84 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.098 1.759 . . . . 0.0 112.591 -176.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.6 ttt180 -54.73 -44.94 74.0 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.74 1.216 . . . . 0.0 113.106 175.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.7 -41.72 52.87 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.96 0.904 . . . . 0.0 111.846 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.0 mt -60.84 -52.48 64.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.454 1.101 . . . . 0.0 112.493 -177.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.22 -33.1 75.2 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.351 0.661 . . . . 0.0 110.981 178.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -64.45 -42.15 96.14 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.99 176.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 5.0 mtp -64.47 -35.94 82.58 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.182 0.901 . . . . 0.0 112.136 173.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.18 -41.79 94.28 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.465 -1.397 . . . . 0.0 112.605 173.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.4 t -63.75 -16.15 60.43 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.45 1.1 . . . . 0.0 113.632 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -113.55 15.28 19.01 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.814 1.412 . . . . 0.0 114.814 176.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 70.83 37.14 1.38 Allowed 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.393 1.477 . . . . 0.0 113.389 175.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.2 mp -121.62 -33.48 3.6 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.124 1.37 . . . . 0.0 113.62 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 3.8 mp -118.73 161.76 19.58 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.623 1.169 . . . . 0.0 112.53 172.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -144.58 120.49 10.63 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.441 1.496 . . . . 0.0 110.374 172.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 43.9 ttp -87.84 144.44 26.59 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.193 -0.942 . . . . 0.0 112.111 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.71 126.17 41.69 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 125.414 1.486 . . . . 0.0 109.977 173.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -74.0 -4.11 33.33 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 124.702 1.201 . . . . 0.0 113.629 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -90.7 -33.91 15.6 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.552 1.141 . . . . 0.0 112.817 -175.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.5 t -141.26 10.19 2.1 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.855 1.262 . . . . 0.0 113.225 -178.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt 51.04 38.12 19.74 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 127.189 2.196 . . . . 0.0 113.584 -169.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.01 117.79 25.08 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.995 -176.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -81.56 121.53 26.43 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.391 1.076 . . . . 0.0 110.459 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -112.2 164.41 13.23 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.89 2.076 . . . . 0.0 108.754 171.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.61 126.92 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 124.154 0.982 . . . . 0.0 108.516 169.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -64.0 88.81 0.05 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.576 1.551 . . . . 0.0 112.02 179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.269 0 C-N-CA 127.987 2.515 . . . . 0.0 113.203 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.7 m . . . . . 0 N--CA 1.488 1.432 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -76.7 166.62 23.12 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.447 1.099 . . . . 0.0 112.587 176.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -63.16 152.76 36.47 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.9 0.88 . . . . 0.0 113.348 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -88.53 3.42 50.34 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -176.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 52.2 m -107.74 148.13 36.74 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.702 1.601 . . . . 0.0 112.309 -177.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -75.68 169.56 22.03 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 123.532 2.821 . . . . 0.0 111.864 172.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 35.0 tp60 -124.44 109.29 13.1 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.354 1.462 . . . . 0.0 111.634 175.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -94.9 147.6 23.2 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.21 1.004 . . . . 0.0 112.785 174.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 3.4 m -92.58 -32.8 14.67 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.001 1.72 . . . . 0.0 112.935 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -154.69 170.99 20.25 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.931 1.692 . . . . 0.0 111.329 -176.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.04 -31.58 51.87 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.683 1.193 . . . . 0.0 113.3 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -68.47 -50.68 50.6 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.745 1.157 . . . . 0.0 112.074 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -55.11 -46.67 75.59 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.099 0.863 . . . . 0.0 112.122 175.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -55.46 -51.92 65.35 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.344 1.058 . . . . 0.0 113.264 173.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -37.38 83.23 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.232 -0.917 . . . . 0.0 112.504 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.529 HD11 HG12 ' A' ' 140' ' ' VAL . 33.9 mt -56.86 -49.5 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 123.858 0.863 . . . . 0.0 110.59 178.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -62.83 -52.35 63.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.279 0.632 . . . . 0.0 110.658 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -57.74 -42.87 84.81 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.302 1.441 . . . . 0.0 113.184 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -60.11 -54.44 45.84 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.535 1.134 . . . . 0.0 111.375 173.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.7 mt -71.0 -19.18 62.55 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.668 -1.27 . . . . 0.0 113.079 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -72.55 -37.55 68.24 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.36 1.064 . . . . 0.0 110.803 169.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -82.21 -39.79 22.62 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.221 0.609 . . . . 0.0 112.312 -172.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.62 -29.15 12.84 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 177.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.25 -169.17 24.83 Favored Glycine 0 N--CA 1.47 0.91 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 -171.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -64.24 128.97 22.84 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.007 3.138 . . . . 0.0 114.122 -170.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -140.63 163.41 32.95 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.535 1.534 . . . . 0.0 110.762 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -80.43 161.98 24.66 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 120.137 -1.602 . . . . 0.0 112.401 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.538 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.9 -32.11 63.46 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.481 0.712 . . . . 0.0 112.545 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.77 -41.72 91.71 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.96 -0.463 . . . . 0.0 111.412 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.47 -45.39 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 122.906 0.482 . . . . 0.0 109.882 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -62.44 -43.53 98.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.869 0.868 . . . . 0.0 110.468 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.475 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.52 -54.68 42.95 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.708 1.203 . . . . 0.0 109.989 -177.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.5 mt-30 -63.95 -34.45 78.0 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.62 0.768 . . . . 0.0 111.971 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.86 -25.75 64.8 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.437 HD11 HG13 ' A' ' 113' ' ' ILE . 3.2 mt -89.45 -11.94 41.59 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.179 1.391 . . . . 0.0 113.192 170.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.9 6.73 63.28 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.226 1.393 . . . . 0.0 114.129 -177.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.7 mmt -77.76 172.54 13.27 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.281 1.432 . . . . 0.0 110.292 171.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.2 mmt85 -108.21 -30.33 8.43 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -169.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 62.1 p -135.1 156.75 48.49 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.742 1.217 . . . . 0.0 112.062 -174.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.43 -28.73 67.21 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -66.16 -29.38 69.66 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.894 1.278 . . . . 0.0 113.702 175.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.53 -26.78 67.31 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 120.641 0.257 . . . . 0.0 111.14 178.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.529 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.32 -31.11 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.598 0.759 . . . . 0.0 112.427 -175.72 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.18 -40.75 7.49 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.522 1.529 . . . . 0.0 113.066 -176.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.71 -44.69 77.67 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.736 1.214 . . . . 0.0 113.021 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -74.49 -41.95 59.84 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.286 1.034 . . . . 0.0 111.828 175.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.44 -52.05 66.16 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.695 0.798 . . . . 0.0 112.463 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.75 -32.89 74.68 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.476 0.71 . . . . 0.0 111.241 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -70.28 -33.49 71.65 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.786 -0.626 . . . . 0.0 112.242 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 94.2 mtp -72.09 -34.29 68.54 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.598 1.159 . . . . 0.0 111.873 170.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 153' ' ' LEU . 25.4 tttp -63.05 -42.09 99.63 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 120.424 -1.423 . . . . 0.0 112.411 172.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.5 m -67.17 -14.67 63.13 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -114.13 13.77 18.11 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.84 1.793 . . . . 0.0 115.84 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.48 38.02 0.85 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.44 1.496 . . . . 0.0 113.269 178.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.2 mp -119.8 -32.09 4.34 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.086 1.354 . . . . 0.0 113.275 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.453 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.9 mt -126.94 164.44 21.47 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.128 0.971 . . . . 0.0 113.13 175.115 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -149.37 121.93 8.56 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.653 1.981 . . . . 0.0 109.197 174.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 45.5 ttp -90.22 144.73 25.59 Favored 'General case' 0 N--CA 1.469 0.477 0 O-C-N 121.191 -0.943 . . . . 0.0 112.063 173.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.12 126.01 42.0 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 125.126 1.37 . . . . 0.0 110.26 174.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.25 -6.52 43.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.114 0.966 . . . . 0.0 113.181 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -87.29 -34.78 18.78 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.441 1.096 . . . . 0.0 113.117 -175.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.4 t -141.31 10.4 2.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.827 1.251 . . . . 0.0 113.176 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 51.37 38.87 22.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 127.061 2.145 . . . . 0.0 113.521 -169.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -86.83 119.1 26.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.374 0.67 . . . . 0.0 109.962 -175.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -83.51 119.96 25.34 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 124.518 1.127 . . . . 0.0 110.652 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.97 135.13 54.34 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.969 1.707 . . . . 0.0 108.915 175.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -55.38 130.04 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 O-C-N 120.57 -1.331 . . . . 0.0 109.622 169.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -67.37 86.8 0.18 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.959 1.303 . . . . 0.0 112.36 -177.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 60.8 ttp85 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 129.178 2.991 . . . . 0.0 113.552 -178.344 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 33.0 m . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -89.7 -63.7 1.25 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.012 0.925 . . . . 0.0 112.541 -176.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 21.1 mmt 50.77 34.81 10.72 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 126.366 1.867 . . . . 0.0 115.549 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -69.87 153.28 43.5 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.769 0.827 . . . . 0.0 112.906 178.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 44.7 m -67.13 145.61 98.8 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 124.195 0.998 . . . . 0.0 112.519 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -80.46 171.39 14.82 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.542 2.828 . . . . 0.0 112.83 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -124.41 119.69 29.94 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.88 1.672 . . . . 0.0 110.096 169.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -90.8 154.59 19.41 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.1 t -96.15 -31.64 12.88 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.508 1.523 . . . . 0.0 113.214 177.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -144.62 162.43 36.67 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -48.61 -43.35 36.17 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.258 1.823 . . . . 0.0 112.97 178.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 -64.16 -40.5 96.27 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.472 0.578 . . . . 0.0 112.196 -178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.85 -44.81 96.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.068 0.947 . . . . 0.0 111.279 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.53 -46.58 82.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.654 0.781 . . . . 0.0 111.864 174.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -59.37 -44.95 92.66 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.649 0.78 . . . . 0.0 112.317 176.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.482 HD11 HG12 ' A' ' 140' ' ' VAL . 49.1 mt -58.65 -50.32 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.537 1.135 . . . . 0.0 111.12 178.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -64.77 -50.28 67.44 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.296 0.639 . . . . 0.0 110.821 -178.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -57.33 -45.95 83.77 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.727 1.211 . . . . 0.0 112.245 177.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -58.12 -53.99 52.02 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.093 0.957 . . . . 0.0 111.433 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.7 mt -70.48 -18.9 62.97 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.82 -1.175 . . . . 0.0 113.193 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -74.35 -36.12 63.59 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 123.557 0.743 . . . . 0.0 111.415 169.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -82.26 -38.67 24.09 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.528 0.731 . . . . 0.0 112.234 -173.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.81 -28.62 12.7 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.42 -168.58 24.22 Favored Glycine 0 N--CA 1.469 0.898 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -172.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.444 ' HB3' HG22 ' A' ' 163' ' ' THR . 43.5 Cg_endo -62.49 127.88 22.05 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 124.066 3.177 . . . . 0.0 113.983 -171.129 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.5 mm-40 -141.28 163.12 33.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.205 1.402 . . . . 0.0 111.144 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 51.6 mtt85 -81.08 160.09 24.56 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 120.253 -1.529 . . . . 0.0 111.924 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.542 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.03 -31.82 63.46 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.138 0.575 . . . . 0.0 112.412 -177.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.9 tp -64.83 -41.93 95.35 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.946 -0.471 . . . . 0.0 111.401 176.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.68 -45.34 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.096 0.558 . . . . 0.0 109.679 174.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.542 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -62.64 -44.19 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.74 0.816 . . . . 0.0 110.408 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.442 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.56 -54.76 40.01 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.105 1.362 . . . . 0.0 110.096 -177.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -64.0 -34.34 77.77 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.381 0.672 . . . . 0.0 112.102 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.17 -25.18 64.23 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 177.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.447 HD11 HG13 ' A' ' 113' ' ' ILE . 2.8 mt -88.94 -12.0 42.85 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.378 1.471 . . . . 0.0 113.157 169.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.86 11.0 59.47 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.838 1.209 . . . . 0.0 114.119 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.1 mmt -83.43 176.3 9.18 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.964 1.706 . . . . 0.0 110.817 172.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -105.88 -38.81 6.23 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -171.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 71.7 p -130.45 156.37 44.87 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.459 1.103 . . . . 0.0 112.504 -169.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -57.8 -28.2 63.82 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.42 1.088 . . . . 0.0 113.802 175.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -69.3 -25.37 64.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.889 1.276 . . . . 0.0 113.797 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -68.29 -27.95 66.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.12 0.486 . . . . 0.0 111.095 176.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.482 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -101.67 -31.25 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.539 0.736 . . . . 0.0 112.531 -173.109 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.2 -41.45 8.29 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.048 1.739 . . . . 0.0 112.485 -176.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -54.39 -43.55 71.51 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.581 1.152 . . . . 0.0 113.34 175.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.34 -45.32 32.67 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.548 0.739 . . . . 0.0 111.384 175.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.37 -52.04 66.98 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.326 1.05 . . . . 0.0 112.662 -177.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -36.15 82.81 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.629 0.772 . . . . 0.0 110.779 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -68.09 -37.38 81.14 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.771 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.7 mtp -67.41 -34.65 77.69 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.944 0.898 . . . . 0.0 111.19 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -61.9 -46.04 91.11 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.608 -1.308 . . . . 0.0 113.136 171.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 59.9 m -63.74 -16.04 60.11 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 175.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 4.5 ptp85 -113.82 16.24 18.48 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 176.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.3 t60 71.42 37.92 1.09 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.863 1.265 . . . . 0.0 113.241 175.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -118.84 -33.4 4.23 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.767 1.627 . . . . 0.0 112.674 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.2 mt -128.31 164.33 22.85 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -150.87 116.51 5.46 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.115 1.766 . . . . 0.0 109.771 176.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 47.2 ttp -85.79 144.57 27.67 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.713 -0.617 . . . . 0.0 111.943 174.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -94.05 125.83 38.91 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 125.514 1.526 . . . . 0.0 108.977 170.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.0 -8.15 54.41 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 121.005 -1.059 . . . . 0.0 112.885 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -84.44 -35.66 22.88 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.866 1.266 . . . . 0.0 112.835 -171.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.7 t -139.46 14.25 2.56 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.032 0.933 . . . . 0.0 112.955 172.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt 54.01 41.18 32.13 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 127.156 2.182 . . . . 0.0 113.134 -173.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -85.17 119.79 25.95 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.558 0.743 . . . . 0.0 109.863 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -83.59 124.61 30.96 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.964 1.306 . . . . 0.0 110.69 173.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.4 p -129.34 127.34 40.88 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.379 1.471 . . . . 0.0 107.8 -174.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.0 130.3 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 O-C-N 120.58 -1.325 . . . . 0.0 110.451 178.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -67.74 86.83 0.22 Allowed 'General case' 0 CA--C 1.547 0.828 0 CA-C-O 122.657 1.218 . . . . 0.0 112.032 -177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 49.4 tpt85 . . . . . 0 C--O 1.253 1.285 0 C-N-CA 128.139 2.576 . . . . 0.0 111.85 -175.176 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 37.0 m . . . . . 0 N--CA 1.488 1.463 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -79.51 155.39 28.26 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.982 0.913 . . . . 0.0 111.948 175.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.5 mmt -104.52 9.66 35.39 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.08 1.352 . . . . 0.0 114.411 -171.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -80.08 143.99 33.5 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.532 1.133 . . . . 0.0 112.922 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 57.2 p -155.12 153.58 27.34 Favored Pre-proline 0 N--CA 1.475 0.794 0 C-N-CA 126.098 1.759 . . . . 0.0 110.678 173.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -78.46 167.94 22.12 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.745 2.297 . . . . 0.0 112.229 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -124.49 109.39 13.2 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.661 1.584 . . . . 0.0 109.746 169.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -75.4 132.84 41.15 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.63 -0.668 . . . . 0.0 110.499 175.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 9.2 t -77.3 -28.16 53.2 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.636 -0.665 . . . . 0.0 112.427 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -147.02 163.55 35.87 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.171 1.388 . . . . 0.0 112.204 177.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -49.01 -34.71 13.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.916 1.686 . . . . 0.0 113.233 177.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -67.36 -40.65 85.78 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 -178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -58.62 -49.07 78.85 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 119.115 0.87 . . . . 0.0 111.01 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.56 -46.43 86.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.005 0.522 . . . . 0.0 112.058 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -63.4 -42.62 98.79 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 176.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.51 HG13 HD11 ' A' ' 132' ' ' LEU . 41.8 mt -58.27 -49.73 80.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 C-N-CA 124.612 1.165 . . . . 0.0 110.814 176.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -61.76 -51.66 67.42 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 124.013 0.925 . . . . 0.0 111.263 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 61.3 ttp85 -61.27 -42.47 98.7 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.53 1.532 . . . . 0.0 112.377 -178.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.6 -52.11 66.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.701 0.8 . . . . 0.0 111.452 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.439 HD12 HD21 ' A' ' 153' ' ' LEU . 88.4 mt -71.3 -18.43 62.41 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.934 -1.104 . . . . 0.0 112.859 178.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.46 ' HA ' HD11 ' A' ' 164' ' ' ILE . 12.0 ttmt -69.96 -36.23 75.1 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.939 0.896 . . . . 0.0 110.386 169.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.28 -39.91 27.9 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -174.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -111.22 -21.04 12.1 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -177.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 86.85 -165.5 36.51 Favored Glycine 0 N--CA 1.476 1.34 0 CA-C-O 117.987 -1.451 . . . . 0.0 111.281 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -54.48 120.82 8.67 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 123.871 3.047 . . . . 0.0 114.531 -171.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 65.1 mm-40 -135.41 157.04 47.89 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.473 1.509 . . . . 0.0 110.175 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -76.63 162.21 27.92 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 119.932 -1.73 . . . . 0.0 111.867 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.541 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.84 -30.97 62.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.169 0.588 . . . . 0.0 112.139 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.15 -42.5 93.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.792 -0.568 . . . . 0.0 111.288 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 36.3 t -59.3 -45.7 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.059 0.544 . . . . 0.0 109.669 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.541 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -62.61 -44.14 99.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.859 0.864 . . . . 0.0 110.294 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.43 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -54.99 -54.58 41.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.291 1.436 . . . . 0.0 109.954 -178.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -64.53 -34.33 77.99 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.126 0.571 . . . . 0.0 112.036 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.83 -24.67 64.4 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.638 0.775 . . . . 0.0 113.041 177.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.51 HD11 HG13 ' A' ' 113' ' ' ILE . 2.6 mt -90.04 -11.93 40.03 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.66 1.584 . . . . 0.0 113.533 169.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.82 10.82 61.08 Favored Glycine 0 CA--C 1.538 1.488 0 C-N-CA 124.736 1.16 . . . . 0.0 114.345 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.9 mmt -83.41 175.78 9.58 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.928 1.691 . . . . 0.0 110.76 172.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -107.74 -34.92 6.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.46 1.282 . . . . 0.0 114.46 -170.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.2 p -131.95 155.99 46.96 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.541 1.136 . . . . 0.0 112.308 -171.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.04 -28.33 64.39 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.517 1.127 . . . . 0.0 113.688 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -69.33 -25.49 64.23 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.878 1.271 . . . . 0.0 113.734 176.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -68.27 -27.43 66.32 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.283 0.492 . . . . 0.0 110.941 177.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.472 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -102.42 -31.22 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 123.592 0.757 . . . . 0.0 112.655 -173.476 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.28 -41.64 8.81 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.636 1.575 . . . . 0.0 112.741 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -41.14 69.96 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.803 1.241 . . . . 0.0 113.423 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -79.77 -41.49 26.45 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.2 1.0 . . . . 0.0 112.147 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.07 -52.79 63.42 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.591 0.756 . . . . 0.0 112.226 -178.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -34.19 77.67 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.744 0.818 . . . . 0.0 111.204 178.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 16.1 mtp-105 -60.19 -46.41 89.81 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 119.172 -0.442 . . . . 0.0 110.636 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.4 ' HB2' HD12 ' A' ' 153' ' ' LEU . 33.9 mtp -66.95 -35.13 79.29 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.057 0.943 . . . . 0.0 111.793 178.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -65.33 -38.31 89.74 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.667 -1.27 . . . . 0.0 113.121 174.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 48.5 m -72.1 -14.55 61.87 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.213 1.005 . . . . 0.0 113.574 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -113.92 13.48 18.33 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 178.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 73.26 36.71 0.8 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.882 1.673 . . . . 0.0 114.148 178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.7 mp -121.38 -32.08 3.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.069 1.348 . . . . 0.0 113.668 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.461 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.7 mt -124.34 164.01 20.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.453 1.101 . . . . 0.0 113.036 173.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -148.42 115.42 6.1 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.348 1.859 . . . . 0.0 108.82 179.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 40.5 ttp -87.67 141.41 28.63 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.379 -0.826 . . . . 0.0 111.587 172.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.84 126.68 37.02 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 124.713 1.205 . . . . 0.0 110.066 175.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -71.48 -7.12 45.42 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 124.273 1.029 . . . . 0.0 113.19 177.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -90.22 -33.88 16.01 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.595 1.158 . . . . 0.0 112.882 -173.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 5.2 t -142.0 11.26 1.99 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.99 1.316 . . . . 0.0 113.127 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 51.29 37.77 19.64 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 127.361 2.264 . . . . 0.0 114.106 -171.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -89.59 116.88 28.06 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.602 -175.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -79.2 122.34 26.16 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.044 1.337 . . . . 0.0 111.294 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.4 t -132.18 144.43 50.66 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.809 1.643 . . . . 0.0 112.914 171.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . 0.46 HD11 ' HA ' ' A' ' 118' ' ' LYS . 0.4 OUTLIER -55.73 125.79 11.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 126.088 1.755 . . . . 0.0 111.29 179.707 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -65.1 89.42 0.08 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.503 1.521 . . . . 0.0 112.829 -177.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 77.0 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 128.301 2.64 . . . . 0.0 112.279 171.346 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -73.24 -32.53 64.78 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.843 0.857 . . . . 0.0 113.208 -178.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 24.8 ptp -145.67 161.45 39.85 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.395 1.478 . . . . 0.0 112.192 175.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -79.97 162.77 24.73 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.289 1.036 . . . . 0.0 112.755 174.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 22.2 m 65.29 153.7 0.12 Allowed Pre-proline 0 N--CA 1.483 1.201 0 C-N-CA 127.227 2.211 . . . . 0.0 115.294 -178.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -73.64 171.64 17.39 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.313 2.675 . . . . 0.0 112.243 174.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -124.24 116.84 23.33 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.497 1.519 . . . . 0.0 111.264 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -98.37 144.15 28.07 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.487 1.115 . . . . 0.0 112.551 174.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 1.5 m -94.19 -29.89 14.89 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.887 1.675 . . . . 0.0 112.723 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -153.52 167.37 29.71 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.907 1.683 . . . . 0.0 111.421 -175.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -33.29 53.96 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.819 1.247 . . . . 0.0 113.237 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -68.8 -45.48 71.16 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 119.517 1.053 . . . . 0.0 112.307 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -58.9 -42.99 90.88 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 110.882 177.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -63.11 -50.92 68.61 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.415 1.086 . . . . 0.0 112.552 175.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.16 -38.34 90.24 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.619 -0.705 . . . . 0.0 112.525 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.507 HD11 HG12 ' A' ' 140' ' ' VAL . 44.1 mt -58.69 -50.75 78.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 119.248 0.931 . . . . 0.0 110.746 176.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.36 -51.65 66.76 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.987 0.115 . . . . 0.0 110.749 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -57.38 -43.92 84.01 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.184 1.394 . . . . 0.0 113.07 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -59.16 -54.08 51.06 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.194 0.998 . . . . 0.0 111.286 174.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 86.8 mt -70.93 -19.43 62.58 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.744 -1.222 . . . . 0.0 113.087 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -73.14 -36.89 66.75 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 124.075 0.95 . . . . 0.0 111.117 169.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -82.42 -39.14 23.03 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.339 0.656 . . . . 0.0 112.27 -172.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.14 -28.1 12.87 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.117 1.155 . . . . 0.0 114.117 177.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.71 -168.62 25.14 Favored Glycine 0 CA--C 1.528 0.905 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.415 ' HB3' HG22 ' A' ' 163' ' ' THR . 41.8 Cg_endo -62.41 128.49 23.83 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.993 3.129 . . . . 0.0 114.006 -170.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -139.74 164.25 30.45 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.14 1.376 . . . . 0.0 111.09 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.4 mtt-85 -78.86 157.53 28.31 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 120.432 -1.418 . . . . 0.0 111.119 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.538 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -53.81 -32.76 53.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.597 0.759 . . . . 0.0 112.542 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 32.1 tp -64.9 -41.05 95.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.245 0.618 . . . . 0.0 111.684 177.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 31.6 t -60.66 -45.43 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.8 mm -61.1 -44.07 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.428 0.691 . . . . 0.0 110.459 178.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.469 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.21 -54.98 38.79 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.131 1.372 . . . . 0.0 110.161 -177.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -64.27 -34.3 77.8 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.275 0.63 . . . . 0.0 111.959 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.71 -24.82 64.53 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 177.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.459 HD11 HG13 ' A' ' 113' ' ' ILE . 3.0 mt -90.51 -12.02 38.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.087 1.355 . . . . 0.0 113.301 170.126 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 94.55 11.65 56.77 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 125.129 1.347 . . . . 0.0 114.371 -178.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.3 mmt -84.0 176.13 9.06 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.036 1.734 . . . . 0.0 110.99 173.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -107.49 -35.64 6.7 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -171.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.9 p -133.34 157.22 46.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.608 1.163 . . . . 0.0 112.05 -171.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.15 -28.22 66.38 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 176.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.75 -28.95 68.82 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.741 1.216 . . . . 0.0 113.765 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.92 -28.36 68.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.949 0.404 . . . . 0.0 111.116 178.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.507 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -100.34 -31.19 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.706 0.802 . . . . 0.0 112.239 -174.403 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -45.07 -41.22 7.46 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 125.733 1.613 . . . . 0.0 112.617 -175.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -55.48 -42.86 74.96 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.63 1.172 . . . . 0.0 113.465 176.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -77.24 -43.46 33.42 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.072 0.949 . . . . 0.0 111.562 174.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 83.6 mt -59.08 -51.92 67.98 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.073 0.949 . . . . 0.0 112.433 -177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -34.71 78.29 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.327 0.651 . . . . 0.0 111.256 179.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.1 mtt-85 -64.24 -38.77 92.24 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.075 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 91.1 mtp -67.65 -35.49 78.98 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.155 0.982 . . . . 0.0 111.997 174.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -63.3 -38.62 91.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 120.787 -1.196 . . . . 0.0 113.132 170.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.3 t -68.96 -18.17 64.04 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -113.84 15.89 18.53 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.812 1.782 . . . . 0.0 115.812 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 34.7 t-80 72.02 38.43 0.91 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.328 1.451 . . . . 0.0 113.395 175.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.6 mp -120.66 -32.83 3.94 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.978 1.711 . . . . 0.0 113.081 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.4 mt -128.02 163.7 23.98 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.5 1.045 . . . . 0.0 113.781 176.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -147.69 115.45 6.4 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.959 2.103 . . . . 0.0 108.969 178.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.9 ttp -88.47 143.87 26.71 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.687 -0.633 . . . . 0.0 111.757 174.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -89.68 130.6 35.94 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.74 1.216 . . . . 0.0 109.619 170.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.97 -7.57 54.92 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.975 0.91 . . . . 0.0 113.016 174.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -88.72 -34.16 17.27 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.33 0.652 . . . . 0.0 112.548 -173.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.21 13.13 1.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.47 1.108 . . . . 0.0 113.78 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt 53.07 38.98 28.77 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 126.227 1.811 . . . . 0.0 113.265 -174.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.65 118.37 23.8 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.589 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -85.2 122.67 29.72 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.456 1.103 . . . . 0.0 110.866 174.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.415 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -127.24 129.44 47.78 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.752 1.621 . . . . 0.0 108.555 -176.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.74 128.86 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.787 -1.196 . . . . 0.0 110.813 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -68.27 90.56 0.35 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.792 1.237 . . . . 0.0 112.031 -177.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? . . . . . 0 C--O 1.253 1.286 0 C-N-CA 127.539 2.336 . . . . 0.0 111.346 176.986 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 61.4 p . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 120.761 0.315 . . . . 0.0 111.745 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -141.95 152.3 43.37 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.2 1.4 . . . . 0.0 111.922 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 48.5 ttp -145.04 153.95 42.0 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.645 1.578 . . . . 0.0 110.627 176.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.09 4.56 6.57 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -172.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 23.6 p -70.0 141.65 89.61 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 124.718 1.207 . . . . 0.0 111.849 171.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -78.94 169.43 19.41 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.02 2.48 . . . . 0.0 112.932 -177.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -124.01 110.1 14.36 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.824 2.049 . . . . 0.0 108.526 170.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -76.98 143.84 39.16 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -169.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.0 t -78.29 -32.49 49.45 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.351 1.06 . . . . 0.0 112.733 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -151.54 164.63 36.41 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.633 1.173 . . . . 0.0 112.845 177.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -49.15 -39.06 27.5 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.89 1.676 . . . . 0.0 113.178 177.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.3 mtm180 -68.12 -39.76 82.69 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.816 0.735 . . . . 0.0 112.289 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -59.79 -44.8 93.77 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.164 0.986 . . . . 0.0 110.585 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.88 -49.55 74.41 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.266 1.026 . . . . 0.0 112.45 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.63 -41.35 98.96 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.693 0.797 . . . . 0.0 113.028 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.477 HD11 HG12 ' A' ' 140' ' ' VAL . 45.6 mt -60.56 -49.55 83.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 124.231 1.012 . . . . 0.0 110.653 177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.88 -50.67 69.98 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.668 0.387 . . . . 0.0 111.098 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -58.17 -44.46 88.0 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 125.351 1.46 . . . . 0.0 112.807 178.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -59.06 -53.34 59.46 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.951 0.9 . . . . 0.0 111.385 174.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 87.1 mt -70.9 -18.69 62.66 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.773 -1.204 . . . . 0.0 113.104 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.4 ttmt -73.26 -36.0 66.29 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.69 0.796 . . . . 0.0 110.76 169.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -83.76 -38.34 21.46 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.403 0.681 . . . . 0.0 112.318 -171.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.93 -26.62 13.36 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 176.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.87 -167.25 26.68 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -172.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.433 ' HB3' HG22 ' A' ' 163' ' ' THR . 53.1 Cg_endo -63.86 128.2 21.43 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 123.943 3.095 . . . . 0.0 113.936 -170.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 66.6 mm-40 -139.52 164.65 29.34 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 125.27 1.428 . . . . 0.0 111.385 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 57.5 mtt-85 -79.25 157.79 27.71 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 120.364 -1.46 . . . . 0.0 111.082 177.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.32 -32.74 57.36 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.456 0.702 . . . . 0.0 112.567 -179.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.0 tp -65.98 -39.65 90.53 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.197 0.599 . . . . 0.0 111.887 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 29.6 t -60.9 -45.06 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.531 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.7 mm -61.6 -44.01 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.349 0.66 . . . . 0.0 110.639 178.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.448 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.71 -54.92 38.34 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 125.028 1.331 . . . . 0.0 110.028 -177.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.55 -33.41 75.83 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.216 0.606 . . . . 0.0 112.067 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.05 -25.16 64.32 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.465 HD11 HG13 ' A' ' 113' ' ' ILE . 2.4 mt -89.5 -12.06 41.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.209 1.404 . . . . 0.0 113.097 169.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.9 9.25 59.85 Favored Glycine 0 CA--C 1.536 1.389 0 C-N-CA 125.174 1.369 . . . . 0.0 114.276 -177.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 11.7 mmt -83.37 172.72 12.21 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.035 1.734 . . . . 0.0 111.06 174.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 26.0 mmt85 -107.96 -28.96 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.089 1.514 . . . . 0.0 115.089 -169.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 69.5 p -132.15 152.71 51.12 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.952 1.301 . . . . 0.0 111.739 -171.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -58.2 -29.77 65.94 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.99 0.916 . . . . 0.0 112.614 171.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 51.0 tttp -67.54 -23.69 65.46 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 127.231 2.213 . . . . 0.0 114.696 174.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -70.35 -28.65 65.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.792 0.724 . . . . 0.0 110.879 174.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.477 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -100.79 -31.51 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.276 0.63 . . . . 0.0 112.336 -171.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -44.42 -40.75 5.71 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.027 1.731 . . . . 0.0 113.021 -176.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -45.5 77.2 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.579 1.152 . . . . 0.0 112.852 175.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.98 -40.95 60.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.231 1.012 . . . . 0.0 112.012 174.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.0 -52.8 62.54 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.557 0.743 . . . . 0.0 112.173 -177.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.04 -34.62 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.68 -0.637 . . . . 0.0 111.343 177.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -57.91 -48.06 81.0 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 122.45 0.3 . . . . 0.0 110.261 173.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.1 mtp -64.08 -35.6 81.28 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 124.325 1.05 . . . . 0.0 111.515 178.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -64.75 -37.12 86.54 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.983 -1.073 . . . . 0.0 113.689 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 9.1 t -71.55 -18.13 62.27 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -113.73 15.4 18.76 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 115.408 1.632 . . . . 0.0 115.408 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.9 t60 71.64 39.27 0.89 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.502 1.521 . . . . 0.0 113.981 175.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.7 mp -122.16 -32.63 3.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.177 1.791 . . . . 0.0 113.099 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.401 HD11 ' CG2' ' A' ' 113' ' ' ILE . 11.1 mt -128.53 163.81 24.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.641 1.11 . . . . 0.0 113.665 176.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -148.79 115.24 5.89 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.795 2.038 . . . . 0.0 108.959 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -89.62 140.9 29.1 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.649 0.738 . . . . 0.0 111.76 174.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -102.05 107.0 17.97 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 126.259 1.823 . . . . 0.0 107.382 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -65.4 -8.88 20.84 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.089 1.356 . . . . 0.0 112.868 -176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -66.09 -32.83 74.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.68 1.992 . . . . 0.0 112.283 177.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -150.13 16.7 0.84 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.885 1.068 . . . . 0.0 113.885 173.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.1 mptt 50.22 39.93 20.96 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.345 2.258 . . . . 0.0 113.384 -170.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -79.84 118.27 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.383 0.673 . . . . 0.0 109.866 174.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -83.4 127.05 33.37 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.333 1.453 . . . . 0.0 111.428 173.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.433 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.0 OUTLIER -132.81 129.54 38.66 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.859 1.664 . . . . 0.0 108.494 -174.581 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.39 129.52 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 O-C-N 120.497 -1.377 . . . . 0.0 111.301 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.1 88.01 0.41 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.046 1.338 . . . . 0.0 112.187 -177.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.845 2.058 . . . . 0.0 113.519 176.455 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.4 m . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -129.28 160.08 34.12 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.462 1.505 . . . . 0.0 111.995 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 15.7 tpt -68.36 138.19 55.2 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.842 0.857 . . . . 0.0 111.744 177.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.44 150.62 25.93 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.327 1.051 . . . . 0.0 112.908 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 60.4 p 63.07 146.89 0.09 OUTLIER Pre-proline 0 N--CA 1.481 1.117 0 C-N-CA 128.639 2.775 . . . . 0.0 116.512 -177.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -81.04 173.46 11.88 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 124.169 3.246 . . . . 0.0 112.572 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -124.28 109.27 13.16 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.14 1.376 . . . . 0.0 111.84 172.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -90.11 144.7 25.65 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.243 1.017 . . . . 0.0 112.099 175.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 6.4 m -92.52 -23.95 18.93 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.65 1.18 . . . . 0.0 114.105 173.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -153.24 167.48 29.18 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.9 0.88 . . . . 0.0 113.287 178.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -46.66 -42.72 16.82 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.997 1.719 . . . . 0.0 113.005 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 25.9 mtt180 -62.86 -45.4 92.74 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.73 0.695 . . . . 0.0 112.599 -179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -62.32 -45.78 91.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.291 0.567 . . . . 0.0 111.521 -179.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.22 -48.93 75.5 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.718 0.807 . . . . 0.0 112.459 171.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.8 -46.21 88.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.005 0.922 . . . . 0.0 112.384 175.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.456 HD11 HG12 ' A' ' 140' ' ' VAL . 39.9 mt -57.73 -50.09 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 124.585 1.154 . . . . 0.0 110.948 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -65.09 -50.99 63.98 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.026 0.531 . . . . 0.0 110.893 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 16.7 tpt180 -56.7 -45.56 81.75 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.522 1.129 . . . . 0.0 111.968 178.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -58.44 -54.3 48.55 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.138 0.975 . . . . 0.0 111.434 175.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 84.4 mt -70.53 -18.9 62.94 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 120.861 -1.149 . . . . 0.0 113.359 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 67.1 tttt -74.34 -36.33 63.64 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 118.829 0.74 . . . . 0.0 111.423 169.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -81.77 -38.63 25.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.418 0.687 . . . . 0.0 112.322 -173.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.98 -29.03 12.78 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 97.66 -168.85 24.1 Favored Glycine 0 CA--C 1.53 0.997 0 N-CA-C 110.577 -1.009 . . . . 0.0 110.577 -171.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.416 ' HB3' HG22 ' A' ' 163' ' ' THR . 48.7 Cg_endo -63.22 127.81 21.09 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.166 3.244 . . . . 0.0 114.126 -171.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -141.41 162.68 34.89 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.234 1.414 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -79.32 161.38 26.29 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 120.153 -1.592 . . . . 0.0 112.503 178.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.542 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -56.05 -32.39 64.01 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.244 0.618 . . . . 0.0 112.413 -179.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 29.6 tp -65.09 -41.58 94.88 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.789 -0.569 . . . . 0.0 111.365 177.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.5 t -59.34 -45.06 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.971 0.508 . . . . 0.0 109.896 174.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.542 HG12 ' HA ' ' A' ' 125' ' ' ALA . 1.9 mm -63.73 -43.0 97.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.758 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.437 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -55.85 -54.78 40.33 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.13 1.372 . . . . 0.0 110.06 -178.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -63.93 -34.55 78.22 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.251 0.62 . . . . 0.0 111.939 -179.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.51 -25.46 64.06 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 177.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.452 HD11 HG13 ' A' ' 113' ' ' ILE . 3.6 mt -88.48 -11.88 44.6 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.567 1.547 . . . . 0.0 113.256 170.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 91.99 10.86 60.81 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.697 1.141 . . . . 0.0 114.144 -177.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 12.0 mmt -83.47 175.32 9.89 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.988 1.715 . . . . 0.0 110.859 172.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -107.8 -34.62 6.9 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -171.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 63.0 p -132.45 156.78 46.12 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.584 1.154 . . . . 0.0 112.181 -171.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.83 -27.17 66.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.511 1.124 . . . . 0.0 113.732 176.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -66.95 -29.73 69.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.913 1.285 . . . . 0.0 113.773 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -67.2 -23.97 65.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.861 0.362 . . . . 0.0 111.516 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.456 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.77 -30.93 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.98 0.912 . . . . 0.0 112.598 -176.235 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.89 -40.62 14.4 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.326 1.45 . . . . 0.0 112.747 -175.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -44.34 77.94 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.495 1.118 . . . . 0.0 112.744 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -73.64 -42.8 60.92 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.807 1.243 . . . . 0.0 111.814 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.2 mt -62.44 -51.52 67.19 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.981 0.913 . . . . 0.0 112.306 -176.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.68 -34.56 78.13 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.27 0.628 . . . . 0.0 110.792 178.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 83.1 mtt-85 -65.64 -37.26 86.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.492 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.7 mtp -68.83 -34.05 74.85 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.066 0.946 . . . . 0.0 111.874 173.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.5 tttp -64.09 -38.66 91.86 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.581 -1.324 . . . . 0.0 112.803 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.95 -14.61 62.79 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 175.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -114.08 14.83 18.39 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 175.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 72.06 38.51 0.89 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.363 1.465 . . . . 0.0 113.417 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 7.9 mp -120.39 -32.86 4.0 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.767 1.627 . . . . 0.0 113.19 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.446 HD11 ' CG2' ' A' ' 113' ' ' ILE . 10.9 mt -128.08 163.44 24.6 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 176.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -150.23 115.37 5.39 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.165 1.786 . . . . 0.0 109.788 177.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 48.9 ttp -84.09 145.97 28.16 Favored 'General case' 0 CA--C 1.539 0.524 0 O-C-N 121.802 -0.561 . . . . 0.0 111.8 174.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -96.15 127.47 42.19 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 125.239 1.415 . . . . 0.0 109.135 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -71.14 -13.83 62.08 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 121.178 -0.951 . . . . 0.0 112.377 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -83.82 -37.34 22.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.678 1.191 . . . . 0.0 113.251 -169.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 6.3 t -134.16 8.11 3.71 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.196 1.398 . . . . 0.0 112.629 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm 51.53 40.18 26.38 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 127.053 2.141 . . . . 0.0 113.328 -170.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -87.31 120.38 28.54 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.612 -177.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -82.09 124.81 30.17 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.528 1.131 . . . . 0.0 110.801 172.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.416 HG22 ' HB3' ' A' ' 122' ' ' PRO . 1.5 p -130.36 128.0 40.54 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 108.465 -173.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.37 128.62 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 120.466 -1.397 . . . . 0.0 110.9 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -67.43 90.35 0.24 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.797 1.239 . . . . 0.0 111.89 -178.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 . . . . . 0 C--O 1.254 1.29 0 C-N-CA 126.853 2.061 . . . . 0.0 112.475 179.012 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 41.7 m . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -74.89 -35.31 62.28 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.742 0.817 . . . . 0.0 113.009 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 14.3 tpt -142.38 126.16 17.05 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.135 1.374 . . . . 0.0 111.078 177.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 58.13 166.58 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 127.757 2.423 . . . . 0.0 116.867 178.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.503 ' H ' ' HD2' ' A' ' 103' ' ' PRO . 65.3 m -107.18 -51.95 0.09 OUTLIER Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 125.766 1.627 . . . . 0.0 112.446 170.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.503 ' HD2' ' H ' ' A' ' 102' ' ' SER . 69.2 Cg_endo -73.0 176.21 9.4 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 122.981 2.454 . . . . 0.0 111.747 169.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -123.95 109.06 13.08 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.496 1.118 . . . . 0.0 111.556 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -94.9 140.2 30.27 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.532 1.133 . . . . 0.0 111.549 173.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.8 m -86.27 -24.64 25.88 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 174.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -153.73 167.43 29.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.064 0.946 . . . . 0.0 113.046 -179.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -47.47 -42.4 22.68 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.929 1.692 . . . . 0.0 113.012 177.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -61.64 -46.25 90.58 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 118.684 0.674 . . . . 0.0 112.418 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -62.28 -45.69 92.13 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.708 0.803 . . . . 0.0 111.39 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -56.41 -48.55 76.71 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.912 0.885 . . . . 0.0 112.971 170.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.46 -44.41 95.89 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.061 0.944 . . . . 0.0 112.595 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.53 HD11 HG12 ' A' ' 140' ' ' VAL . 32.9 mt -57.97 -49.52 80.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 124.751 1.22 . . . . 0.0 110.799 178.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -64.28 -50.05 69.43 Favored 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.071 0.548 . . . . 0.0 110.711 -177.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -54.58 -51.42 65.34 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.188 0.995 . . . . 0.0 111.971 175.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 60.9 t80 -54.56 -52.0 63.45 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 123.851 0.86 . . . . 0.0 111.538 179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.32 -19.89 61.58 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.943 -1.098 . . . . 0.0 113.004 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -73.05 -34.27 66.18 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.846 0.858 . . . . 0.0 110.704 169.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -83.63 -39.0 20.82 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.972 0.909 . . . . 0.0 111.706 -170.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.93 -27.93 11.87 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 176.001 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 98.49 -169.81 23.88 Favored Glycine 0 N--CA 1.474 1.186 0 CA-C-O 118.785 -1.008 . . . . 0.0 110.644 -171.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.4 ' HB3' HG22 ' A' ' 163' ' ' THR . 35.6 Cg_endo -61.5 129.53 28.42 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.985 3.124 . . . . 0.0 114.122 -171.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -139.76 164.82 28.94 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.304 1.442 . . . . 0.0 110.785 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.12 158.29 26.42 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 120.33 -1.481 . . . . 0.0 111.068 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.53 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.13 -33.2 57.23 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.445 0.698 . . . . 0.0 112.605 -178.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.9 tp -65.88 -39.93 91.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.178 0.591 . . . . 0.0 111.848 178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 38.0 t -60.31 -45.91 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.53 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -61.05 -43.4 96.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.364 0.665 . . . . 0.0 110.528 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.523 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -57.42 -54.33 48.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.636 1.175 . . . . 0.0 110.077 -177.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -65.28 -33.16 75.32 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 122.987 0.515 . . . . 0.0 112.061 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -68.93 -25.71 64.71 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 177.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.479 HD11 HG13 ' A' ' 113' ' ' ILE . 3.0 mt -88.6 -11.27 45.97 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.249 1.419 . . . . 0.0 113.319 169.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.84 11.54 61.65 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 124.762 1.172 . . . . 0.0 114.236 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 35.2 mtt -80.52 176.21 9.99 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.007 1.723 . . . . 0.0 111.211 171.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -108.14 -35.96 6.43 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.4 p -125.64 152.2 45.5 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.024 1.33 . . . . 0.0 112.312 -170.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.12 -29.09 68.39 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.815 0.846 . . . . 0.0 112.589 172.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 66.3 tttt -64.13 -28.58 69.86 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.935 2.094 . . . . 0.0 114.453 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -72.26 -20.62 61.5 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.822 0.737 . . . . 0.0 111.439 177.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.53 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -105.48 -30.57 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 O-C-N 121.539 -0.725 . . . . 0.0 112.651 -177.157 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -49.07 -40.28 31.06 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.379 1.472 . . . . 0.0 112.389 -173.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -52.38 -50.17 62.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.682 1.193 . . . . 0.0 111.817 173.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -71.15 -41.76 70.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 125.009 1.324 . . . . 0.0 111.654 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 85.5 mt -63.03 -52.9 61.06 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.109 0.963 . . . . 0.0 111.916 -177.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.59 -33.04 74.78 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.776 0.83 . . . . 0.0 111.302 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 48.0 mtp85 -61.52 -43.07 99.53 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.923 174.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 90.1 mtp -69.71 -33.18 72.15 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 123.997 0.919 . . . . 0.0 111.809 177.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -62.8 -42.23 99.62 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.488 -1.382 . . . . 0.0 112.408 170.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 44.9 m -69.18 -13.85 62.65 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 178.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -114.08 14.89 18.39 Favored 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 174.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 72.77 38.46 0.75 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.361 1.464 . . . . 0.0 113.588 176.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.1 mp -121.51 -31.9 3.94 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.731 1.612 . . . . 0.0 113.368 -178.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.445 HD11 ' CG2' ' A' ' 113' ' ' ILE . 10.0 mt -127.35 164.19 22.34 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 175.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -148.38 115.84 6.25 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.809 1.643 . . . . 0.0 110.259 175.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 41.3 ttp -86.15 144.27 27.58 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.343 -0.848 . . . . 0.0 112.034 174.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -85.37 130.61 34.55 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.71 1.204 . . . . 0.0 109.236 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -73.82 -9.34 58.55 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 124.679 1.192 . . . . 0.0 112.878 176.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -90.79 -39.1 12.56 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -174.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -140.64 15.12 2.34 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 -178.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 8.9 mptt 52.72 40.84 31.11 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 126.162 1.785 . . . . 0.0 113.045 -176.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -84.42 117.35 23.58 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.47 177.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.52 122.32 28.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 124.197 0.999 . . . . 0.0 110.637 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.4 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.2 OUTLIER -126.46 131.17 51.72 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 125.513 1.525 . . . . 0.0 108.434 -178.438 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -52.23 133.33 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 O-C-N 121.115 -0.991 . . . . 0.0 110.702 177.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -70.26 102.12 2.05 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.429 0.633 . . . . 0.0 111.193 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.707 2.003 . . . . 0.0 112.758 173.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.554 0.216 . . . . 0.0 111.474 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 19.4 t60 -72.69 149.7 43.58 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.698 1.199 . . . . 0.0 112.639 -178.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.65 11.83 31.9 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -174.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -140.14 161.83 36.69 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.514 1.525 . . . . 0.0 112.227 175.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.509 ' H ' ' HD2' ' A' ' 103' ' ' PRO . 31.8 t -121.65 -53.12 0.04 OUTLIER Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 125.116 1.366 . . . . 0.0 114.292 -177.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.509 ' HD2' ' H ' ' A' ' 102' ' ' SER . 61.2 Cg_endo -74.44 172.95 15.1 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 122.335 2.023 . . . . 0.0 112.617 175.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -123.84 117.52 25.05 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.737 1.615 . . . . 0.0 110.339 174.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -90.71 143.15 27.02 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.813 0.845 . . . . 0.0 112.833 -176.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 6.5 t -86.31 -25.72 25.29 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.044 1.338 . . . . 0.0 112.891 179.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -149.69 165.15 33.22 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.877 1.271 . . . . 0.0 112.296 176.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.28 -33.05 62.89 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.851 1.26 . . . . 0.0 113.091 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 68.7 mtt180 -65.29 -49.92 67.7 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.03 0.832 . . . . 0.0 111.7 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -53.87 -48.65 69.82 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.873 0.76 . . . . 0.0 112.061 174.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.56 -51.25 70.24 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.018 0.927 . . . . 0.0 112.155 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.09 -42.33 99.58 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 118.589 -0.72 . . . . 0.0 112.262 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.475 HD11 HG12 ' A' ' 140' ' ' VAL . 49.5 mt -57.75 -51.31 71.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.66 1.118 . . . . 0.0 111.256 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -65.26 -49.3 70.14 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.124 0.57 . . . . 0.0 110.423 -176.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 46.7 tpt85 -58.59 -43.86 89.65 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.559 1.144 . . . . 0.0 112.825 178.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -60.75 -53.85 52.33 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 124.756 1.222 . . . . 0.0 111.558 175.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.21 -19.54 63.96 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.957 -1.089 . . . . 0.0 112.705 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 38.7 tttm -73.84 -35.48 64.82 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.729 0.695 . . . . 0.0 111.482 169.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -77.72 -41.37 38.09 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.158 0.583 . . . . 0.0 111.957 -174.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.58 -28.01 11.99 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -178.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 96.29 -166.7 24.51 Favored Glycine 0 CA--C 1.529 0.93 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 -172.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.453 ' HB3' HG22 ' A' ' 163' ' ' THR . 47.8 Cg_endo -62.97 125.91 16.91 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.896 3.064 . . . . 0.0 114.124 -169.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 61.2 mm-40 -139.13 162.24 35.43 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.205 1.402 . . . . 0.0 110.973 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 55.9 mtt85 -81.12 160.25 24.48 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 120.282 -1.511 . . . . 0.0 112.032 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -55.2 -32.8 62.51 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 118.6 0.636 . . . . 0.0 112.522 -177.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 28.7 tp -65.74 -40.87 92.59 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.957 -0.464 . . . . 0.0 111.493 177.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 41.1 t -59.14 -46.35 92.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 123.169 0.587 . . . . 0.0 109.638 173.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.531 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.1 mm -62.26 -43.36 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.834 0.853 . . . . 0.0 110.547 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.492 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -58.06 -53.88 53.23 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.504 1.121 . . . . 0.0 110.185 -178.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -64.04 -34.31 77.73 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.072 0.549 . . . . 0.0 111.984 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -67.91 -26.33 65.93 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.422 0.689 . . . . 0.0 112.833 176.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.467 HD11 HG13 ' A' ' 113' ' ' ILE . 4.1 mt -86.35 -11.94 50.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.658 1.583 . . . . 0.0 113.19 169.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 90.94 11.15 61.95 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.831 1.205 . . . . 0.0 113.801 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 29.2 mtt -80.86 176.91 9.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.508 1.923 . . . . 0.0 111.228 173.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -108.04 -37.35 6.09 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -176.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 72.9 p -128.29 155.02 45.27 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.593 1.157 . . . . 0.0 112.52 -170.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.76 -24.94 66.14 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.31 1.044 . . . . 0.0 113.464 175.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -67.08 -28.91 68.57 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.728 1.211 . . . . 0.0 113.324 174.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -72.77 -15.66 61.65 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 118.383 0.538 . . . . 0.0 112.267 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.492 ' CG2' ' HB2' ' A' ' 129' ' ' ALA . 0.0 OUTLIER -108.57 -31.06 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.017 0.927 . . . . 0.0 113.001 178.777 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -50.56 -41.11 53.81 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.07 1.348 . . . . 0.0 112.376 -172.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -55.4 -41.58 72.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.212 1.005 . . . . 0.0 112.639 175.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -76.51 -46.71 25.43 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.313 1.045 . . . . 0.0 111.49 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 84.2 mt -57.09 -51.94 67.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.493 1.117 . . . . 0.0 112.333 -178.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 -35.13 77.57 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.071 0.548 . . . . 0.0 111.247 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -64.43 -40.51 95.89 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 118.467 -0.777 . . . . 0.0 110.767 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.41 ' HA ' ' HG2' ' A' ' 150' ' ' ARG . 87.5 mtp -66.14 -34.8 78.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.673 1.189 . . . . 0.0 111.419 175.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 54.3 tttm -63.66 -40.28 96.45 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 120.531 -1.356 . . . . 0.0 113.112 169.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 7.3 t -69.69 -14.12 62.64 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 175.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . 0.41 ' HG2' ' HA ' ' A' ' 147' ' ' MET . 13.9 ptm180 -114.11 14.7 18.32 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 33.5 t-80 72.11 37.84 0.95 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.531 1.533 . . . . 0.0 113.624 176.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 8.0 mp -120.09 -32.61 4.14 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.657 1.583 . . . . 0.0 113.099 -179.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -127.92 164.08 23.06 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -148.79 115.41 5.94 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.972 2.109 . . . . 0.0 109.178 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.5 ttp -88.8 144.03 26.51 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.569 -0.707 . . . . 0.0 112.147 175.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.94 129.78 37.83 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.446 1.498 . . . . 0.0 110.102 171.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -74.16 -7.3 52.15 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 123.975 0.91 . . . . 0.0 113.147 174.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -84.87 -35.93 21.89 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.657 0.783 . . . . 0.0 112.865 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 2.1 t -144.47 15.77 1.64 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 175.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt 54.27 39.44 30.84 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.094 1.757 . . . . 0.0 113.306 -171.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -82.34 119.0 23.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.387 0.675 . . . . 0.0 109.857 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -86.18 123.19 31.19 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 125.025 1.33 . . . . 0.0 110.601 175.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.453 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -126.95 129.03 47.35 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 125.709 1.604 . . . . 0.0 108.083 -176.291 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.76 129.79 17.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 O-C-N 120.851 -1.155 . . . . 0.0 110.474 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -69.51 91.07 0.56 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.432 1.093 . . . . 0.0 111.255 -179.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 126.615 1.966 . . . . 0.0 112.056 177.86 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 N--CA 1.487 1.39 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 62.37 166.91 0.12 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 127.277 2.231 . . . . 0.0 115.292 -177.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 15.5 tpt -81.29 145.0 31.12 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.715 1.206 . . . . 0.0 112.312 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -144.53 143.3 30.77 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.325 1.45 . . . . 0.0 111.392 172.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 40.4 m -76.96 -48.0 2.69 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -176.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.72 169.6 18.02 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.816 2.344 . . . . 0.0 112.315 178.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -124.33 112.25 16.75 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.446 1.498 . . . . 0.0 111.702 175.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -99.46 148.1 24.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.754 1.222 . . . . 0.0 112.86 172.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.5 t -100.28 -29.15 12.6 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.46 1.904 . . . . 0.0 112.544 176.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -149.26 163.56 37.33 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.882 1.273 . . . . 0.0 112.708 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.19 -34.88 61.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.917 1.287 . . . . 0.0 113.34 -177.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -62.0 -46.67 88.18 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 118.689 0.677 . . . . 0.0 111.321 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -61.36 -49.24 77.75 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.664 1.185 . . . . 0.0 112.389 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -54.64 -46.7 73.99 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.629 1.172 . . . . 0.0 112.484 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.01 -43.73 94.74 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.793 173.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.533 HD11 HG12 ' A' ' 140' ' ' VAL . 42.0 mt -56.7 -49.66 77.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.679 1.127 . . . . 0.0 111.446 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -64.14 -53.17 53.78 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 123.017 0.527 . . . . 0.0 110.61 -177.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.2 ttp85 -57.75 -42.61 84.32 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.862 1.265 . . . . 0.0 113.019 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -58.95 -54.03 51.73 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.288 1.035 . . . . 0.0 111.462 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 85.6 mt -70.55 -18.81 62.92 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 120.75 -1.219 . . . . 0.0 113.137 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -73.04 -35.01 66.66 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 110.924 169.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -85.34 -39.26 17.85 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.405 0.682 . . . . 0.0 112.438 -172.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -100.59 -26.44 13.83 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 94.82 -167.4 26.85 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -173.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' PRO . . . . . 0.438 ' HB3' HG22 ' A' ' 163' ' ' THR . 44.0 Cg_endo -62.49 126.23 17.94 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.947 3.098 . . . . 0.0 113.821 -170.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -139.33 162.6 34.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.035 1.334 . . . . 0.0 110.857 179.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 54.3 mtt85 -80.69 159.75 25.19 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 120.36 -1.463 . . . . 0.0 111.955 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . 0.525 ' HA ' HG12 ' A' ' 128' ' ' ILE . . . -54.72 -33.11 60.63 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.35 0.66 . . . . 0.0 112.552 -177.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 30.8 tp -65.01 -41.9 94.94 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 121.971 -0.456 . . . . 0.0 111.582 177.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.0 -45.78 92.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.238 0.615 . . . . 0.0 109.691 174.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.525 HG12 ' HA ' ' A' ' 125' ' ' ALA . 2.0 mm -61.92 -44.29 98.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 123.783 0.833 . . . . 0.0 110.344 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.512 ' HB2' ' CG2' ' A' ' 140' ' ' VAL . . . -56.8 -54.39 46.96 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.924 1.29 . . . . 0.0 110.194 -177.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -63.47 -34.44 77.76 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.357 0.663 . . . . 0.0 112.007 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.37 -24.73 63.92 Favored 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 177.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.443 HD11 HG13 ' A' ' 113' ' ' ILE . 4.3 mt -88.9 -11.83 43.45 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.642 1.577 . . . . 0.0 113.428 170.119 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 93.54 11.3 58.33 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 125.106 1.336 . . . . 0.0 113.991 -178.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 30.5 mtt -81.33 177.03 9.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 111.29 173.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -107.94 -36.6 6.31 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -175.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 64.2 p -131.54 155.79 46.84 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.736 1.214 . . . . 0.0 112.572 -170.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.57 -28.6 67.28 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.469 1.108 . . . . 0.0 113.523 176.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -66.09 -28.39 68.78 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.587 1.155 . . . . 0.0 113.197 175.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -73.46 -15.34 61.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.533 HG12 HD11 ' A' ' 113' ' ' ILE . 0.0 OUTLIER -108.11 -30.83 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 124.532 1.133 . . . . 0.0 113.192 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.95 -40.71 31.41 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.283 1.433 . . . . 0.0 112.406 -173.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.8 ttt-85 -54.82 -40.86 70.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.511 1.124 . . . . 0.0 112.989 175.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -77.23 -46.46 23.14 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.302 1.041 . . . . 0.0 111.799 176.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 86.8 mt -57.48 -51.77 68.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.394 1.077 . . . . 0.0 112.127 -177.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -33.14 74.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.636 0.774 . . . . 0.0 111.621 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.3 mtp-105 -70.17 -32.28 70.15 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.963 -0.46 . . . . 0.0 112.152 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 88.6 mtp -73.68 -34.09 64.72 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.663 1.185 . . . . 0.0 111.458 171.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -62.67 -42.52 99.66 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.236 -1.54 . . . . 0.0 112.047 171.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 50.1 m -67.05 -13.58 62.06 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 178.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . 0.422 ' HG3' HD13 ' A' ' 152' ' ' LEU . 4.8 ptp180 -113.97 14.93 18.54 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.069 1.507 . . . . 0.0 115.069 176.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 5.7 t60 72.03 38.4 0.91 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.667 1.587 . . . . 0.0 112.94 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' LEU . . . . . 0.422 HD13 ' HG3' ' A' ' 150' ' ' ARG . 5.4 mp -121.52 -32.48 3.82 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.636 1.174 . . . . 0.0 113.752 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 11.5 mt -123.89 164.65 18.84 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.158 0.983 . . . . 0.0 113.227 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -150.2 115.38 5.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.799 2.04 . . . . 0.0 108.854 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' MET . . . . . . . . . . . . . 42.1 ttp -88.43 143.52 26.94 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.708 -0.62 . . . . 0.0 111.9 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -90.21 130.77 36.31 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.018 1.327 . . . . 0.0 109.841 171.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.65 -9.12 58.34 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 123.899 0.88 . . . . 0.0 113.014 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -86.45 -36.46 19.07 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -172.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 1.9 t -143.09 15.86 1.9 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.049 0.94 . . . . 0.0 113.488 176.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp 54.0 40.6 31.77 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.12 1.768 . . . . 0.0 113.307 -172.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -83.92 119.96 25.52 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.591 0.757 . . . . 0.0 109.875 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 93.9 m95 -86.09 123.82 31.82 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.06 1.344 . . . . 0.0 110.824 174.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.438 HG22 ' HB3' ' A' ' 122' ' ' PRO . 0.7 OUTLIER -128.33 130.24 47.49 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.706 1.602 . . . . 0.0 108.743 -175.873 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.81 126.43 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 120.756 -1.215 . . . . 0.0 110.598 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -65.89 95.62 0.26 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.564 1.146 . . . . 0.0 112.48 -177.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 . . . . . 0 C--O 1.253 1.286 0 C-N-CA 128.199 2.6 . . . . 0.0 113.559 171.192 . . . . . . . . 0 0 . 1 stop_ save_