data_2m5i_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 2m5i _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 ' 78' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.456 -0.128 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -58.88 -30.97 68.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.341 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.82 -35.15 79.68 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.195 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -62.78 -34.42 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.2 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.47 -43.76 98.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.349 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.87 -44.12 98.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -58.06 -44.51 87.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.112 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.96 -44.49 92.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 0.0 109.98 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.2 mt -61.58 -42.31 93.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.569 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.84 -51.49 68.79 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -52.31 -44.12 64.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.327 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -60.61 -50.75 72.25 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.99 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.549 ' O ' ' N ' ' A' ' 94' ' ' GLY . 11.7 mt -57.81 -38.32 75.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.974 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.81 74.13 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -57.52 -50.95 71.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.198 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.2 t -71.42 -26.23 26.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 121.229 0.538 . . . . 0.0 110.483 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.14 -28.57 68.06 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.216 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 98' ' ' ASP . 92.6 m-20 -68.79 -37.86 79.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.746 0.308 . . . . 0.0 111.139 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.1 t -71.25 -12.76 61.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.513 -179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 89.8 mmm -71.46 -10.42 59.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.732 0.301 . . . . 0.0 110.974 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' A' ' 95' ' ' ASP . 42.1 p-10 -98.59 8.52 44.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.731 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -155.79 38.44 0.37 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.918 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 56.7 p . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 120.869 0.366 . . . . 0.0 110.431 -179.974 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.511 ' CD1' ' N ' ' A' ' 105' ' ' LEU . 6.3 mp . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.729 0.3 . . . . 0.0 111.046 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 7.2 p -60.17 -33.74 54.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.607 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.6 t-20 -69.15 -50.14 50.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.107 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.89 -48.89 18.27 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.23 -44.15 96.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.808 0.337 . . . . 0.0 110.262 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.553 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.5 tp -66.27 -44.69 82.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.99 0.424 . . . . 0.0 110.55 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -67.62 -35.04 78.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.467 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.1 tp -60.78 -42.69 98.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.59 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -65.88 -39.29 90.54 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.746 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -62.83 -44.68 95.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.582 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 97.3 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.023 179.9 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.539 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 21.3 p-10 . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.417 0.151 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.539 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 54.9 mt -62.61 -35.73 80.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.545 0.212 . . . . 0.0 111.009 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.82 -41.36 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.324 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.5 m -61.77 -44.47 96.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.03 0.443 . . . . 0.0 110.15 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -46.58 80.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.6 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.88 -42.81 99.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.96 -52.84 37.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -59.63 -47.88 83.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.364 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.16 -48.8 76.91 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.268 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.24 -42.62 99.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 -179.663 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 70.0 mtp . . . . . 0 N--CA 1.467 0.386 0 CA-C-O 120.426 0.155 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 147' ' ' THR . 11.1 mt-10 -65.66 -43.79 88.29 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-O 120.876 0.37 . . . . 0.0 110.485 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -63.67 -31.03 72.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.776 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -75.86 -50.67 14.42 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.221 0.534 . . . . 0.0 110.924 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -68.25 -42.07 80.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.603 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.416 ' CB ' ' O ' ' A' ' 143' ' ' GLU . 99.6 m -62.15 -42.51 99.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.389 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 42.0 ttm -59.27 -46.33 88.81 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.65 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.3 -50.31 54.45 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.945 -0.702 . . . . 0.0 110.409 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -42.92 95.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.298 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.405 ' CB ' ' O ' ' A' ' 147' ' ' THR . 48.4 tp -60.93 -43.84 98.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.307 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.76 98.22 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.156 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 51.9 tp -60.62 -41.86 95.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.8 -41.76 96.28 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.103 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 56.2 tp -62.33 -47.12 85.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.955 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.52 79.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -61.42 -45.83 92.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.384 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.86 -38.99 93.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.51 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 83.4 t -66.58 -44.46 89.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.316 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.33 -39.52 92.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.187 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 64.0 m -164.55 167.16 19.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.162 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.445 ' O ' ' C ' ' A' ' 163' ' ' THR . 33.2 m170 -112.63 115.55 28.76 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' THR . . . . . 0.445 ' C ' ' O ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER -29.39 93.55 0.05 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.442 0.464 . . . . 0.0 111.207 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 162' ' ' HIS . 32.5 Cg_exo -55.16 143.69 73.47 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 121.875 1.716 . . . . 0.0 112.291 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 11.0 p . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.828 179.59 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 50.2 mt . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 120.901 0.382 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -64.35 -47.09 80.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.9 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.23 -46.74 85.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.393 . . . . 0.0 110.677 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.1 -44.84 97.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.322 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.45 -43.12 97.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -57.34 -48.89 77.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.721 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 17.7 m -59.9 -47.09 87.17 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.5 m -53.48 -43.06 67.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.117 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.4 t -61.48 -40.86 87.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.326 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 . . . . . 0 CA--C 1.53 0.176 0 CA-C-O 120.856 0.36 . . . . 0.0 110.417 -179.652 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 74.5 mt . . . . . 0 N--CA 1.462 0.149 0 CA-C-O 120.835 0.35 . . . . 0.0 110.646 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . 0.431 ' O ' ' CB ' ' A' ' 187' ' ' ARG . 39.2 mmt-85 -54.37 -31.33 54.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.539 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.6 m -58.15 -47.92 81.84 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.555 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -73.42 -48.1 36.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.003 0.43 . . . . 0.0 111.001 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 86.0 t -62.17 -44.6 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.772 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . 0.431 ' CB ' ' O ' ' A' ' 183' ' ' ARG . 77.9 ttt-85 -62.22 -44.02 97.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.482 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 68.7 m -60.34 -40.76 91.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.886 0.374 . . . . 0.0 110.316 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 53.7 tp . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 -179.844 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.573 0.225 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 68.22 -60.16 0.42 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.612 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -61.24 -33.75 74.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.378 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -58.4 -28.56 65.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.205 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.7 mt -60.91 -47.33 93.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.231 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.409 HG21 HD13 ' A' ' 83' ' ' ILE . 94.3 mt -62.35 -45.1 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -55.82 -44.47 77.92 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.975 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -63.7 -45.09 91.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.017 0.437 . . . . 0.0 110.41 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.424 HG21 HD13 ' A' ' 86' ' ' ILE . 76.6 mt -58.17 -44.58 87.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.105 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.75 93.85 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.425 -0.51 . . . . 0.0 109.813 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -52.6 -45.56 66.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.047 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -46.59 89.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.155 0.502 . . . . 0.0 110.307 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.493 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.0 mp -62.22 -39.57 93.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.074 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.08 -41.32 78.6 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.017 0.437 . . . . 0.0 110.229 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -63.19 -51.9 64.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.111 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.91 -26.36 30.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.245 0.545 . . . . 0.0 110.342 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -73.64 -41.63 42.66 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -63.95 -42.97 97.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.775 0.322 . . . . 0.0 110.632 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 51.1 m -57.09 -39.48 75.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.427 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.04 60.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.293 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 98' ' ' ASP . 67.6 t0 -169.72 42.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.418 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -131.84 -38.38 1.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.467 0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.857 179.852 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.9 mp . . . . . 0 CA--C 1.528 0.113 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 85.6 t -64.32 -46.15 93.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.974 0.416 . . . . 0.0 110.732 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -63.38 -50.34 70.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.883 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -60.71 -32.95 80.62 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.2 tp -61.54 -46.41 90.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -54.96 -48.93 72.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.117 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 11.2 mp -65.84 -39.2 90.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.488 178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.34 -45.26 91.86 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.124 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.4 tp -63.65 -42.59 98.09 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.699 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 116' ' ' THR . 59.2 ttm-85 -75.2 -42.89 54.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.009 0.433 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -44.92 -17.55 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.171 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.479 ' N ' ' O ' ' A' ' 114' ' ' ARG . 16.4 m . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 66.6 t0 . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.1 mt -50.32 -38.19 40.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.451 -178.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.81 -48.95 69.36 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.26 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.3 m -60.94 -42.78 98.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.574 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.52 -47.94 78.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.346 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.91 -41.59 87.62 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.459 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -55.44 -51.41 67.01 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.941 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -53.99 -47.73 71.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.678 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.21 -43.53 94.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.442 . . . . 0.0 109.966 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.4 -46.88 79.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.498 -178.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 . . . . . 0 C--N 1.324 -0.505 0 C-N-CA 120.569 -0.452 . . . . 0.0 109.96 -179.996 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.6 ttp . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.816 0.341 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -65.33 -35.12 80.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 26.9 tptt -61.53 -47.64 84.66 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.837 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -64.01 -41.75 97.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.825 0.345 . . . . 0.0 110.569 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -58.29 -42.24 86.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.45 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.1 m -60.19 -46.84 88.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.709 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.2 mtm -64.59 -41.53 96.19 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.749 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 7.7 mp -63.99 -41.1 97.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.727 0.299 . . . . 0.0 110.626 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.83 -45.06 98.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.476 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.2 tp -61.39 -45.41 94.49 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.463 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.94 -37.0 86.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.639 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.87 -41.92 99.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.417 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.02 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.18 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 91.4 mt -61.39 -43.31 99.08 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.023 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -71.65 -46.62 58.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.47 179.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.97 -37.46 87.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.507 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -61.07 -44.55 97.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.596 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.17 -48.81 86.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.323 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.14 -38.54 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.952 0.406 . . . . 0.0 110.955 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.564 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 29.4 t -72.04 -165.57 0.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.416 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.564 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.9 m-70 167.38 89.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.119 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.1 p -123.74 152.98 66.64 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.584 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -68.03 156.36 66.14 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.489 2.126 . . . . 0.0 111.7 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 83.8 p . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.624 -179.953 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.494 ' CD2' ' N ' ' A' ' 167' ' ' LEU . 3.9 mm? . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.892 0.377 . . . . 0.0 110.519 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -61.87 -38.02 86.72 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.42 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -62.72 -46.89 85.99 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.557 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.0 t -66.63 -48.92 78.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.049 0.452 . . . . 0.0 110.143 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -56.23 -39.46 72.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.628 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -61.56 -41.37 97.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.687 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 99.3 m -59.54 -46.59 88.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.551 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 81.7 m -57.88 -43.71 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.029 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.9 t -56.67 -43.79 79.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.721 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.771 179.703 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 11.1 mp . . . . . 0 C--O 1.221 -0.403 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 187' ' ' ARG . 61.0 ttt85 -51.51 -43.28 62.2 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.498 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -63.44 -52.3 62.04 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.749 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -68.5 -41.0 80.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.833 0.349 . . . . 0.0 111.282 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 189' ' ' LEU . 40.7 t -62.76 -45.77 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.552 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 183' ' ' ARG . 64.5 ttm-85 -60.56 -52.54 64.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.42 -178.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 79.8 p -63.72 -38.95 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.726 0.298 . . . . 0.0 110.616 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.443 ' O ' ' O ' ' A' ' 186' ' ' VAL . 54.7 tp . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.308 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.817 0.342 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.38 -9.47 56.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.18 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -71.34 -37.0 71.74 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.434 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.35 -51.48 69.32 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.281 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.9 tt -65.18 -41.3 91.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.094 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.6 mt -63.09 -42.35 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.171 178.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -55.72 -48.77 74.6 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.623 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -60.84 -41.79 96.53 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.515 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.01 -44.63 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.897 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.85 -46.28 78.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.803 0.335 . . . . 0.0 110.35 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 95.2 mtm-85 -56.25 -43.52 78.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.649 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -64.12 -45.54 88.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.085 0.469 . . . . 0.0 110.475 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.05 -35.69 80.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.204 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.51 82.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.712 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.95 -52.52 55.84 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.529 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.73 -25.93 31.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.758 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.546 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -84.44 -35.34 14.42 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.318 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -65.15 -47.15 78.07 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.537 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 29.8 t -166.0 152.63 9.54 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.725 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.7 tpt -154.93 128.72 8.67 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.144 0.497 . . . . 0.0 110.602 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.563 ' O ' ' N ' ' A' ' 100' ' ' SER . 89.7 m-20 40.09 65.04 0.79 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.226 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -38.02 -24.07 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.188 0.518 . . . . 0.0 110.598 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 98' ' ' ASP . 26.8 t . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.628 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.443 ' CD2' ' N ' ' A' ' 105' ' ' LEU . 4.0 mm? . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.56 0.219 . . . . 0.0 110.63 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.43 ' CG1' ' N ' ' A' ' 107' ' ' ASN . 12.7 p -61.17 -43.77 97.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.643 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.431 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 50.2 t-20 -65.84 -36.4 83.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.0 110.489 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.99 -26.04 4.18 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.466 ' CD2' ' N ' ' A' ' 109' ' ' LEU . 4.0 mm? -62.66 -43.48 98.69 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.022 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.06 -40.09 69.95 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.893 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 50.6 tp -66.69 -41.47 88.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.708 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -54.68 -42.78 71.83 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.31 -40.44 97.34 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.435 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -74.06 -28.12 61.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.421 . . . . 0.0 110.596 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -63.57 -41.88 98.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.696 -179.848 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.549 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 25.6 p-10 . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 111.331 0.123 . . . . 0.0 111.331 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.549 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 51.9 mt -67.1 -34.24 77.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 110.812 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -39.39 66.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.1 m -62.03 -47.35 85.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.433 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.72 -43.59 94.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.946 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.28 -41.7 98.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 110.476 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -60.31 -46.58 89.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.358 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.46 -52.65 63.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.65 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.24 -49.49 73.94 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.157 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 56.7 tp -57.19 -38.08 73.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.274 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 . . . . . 0 C--N 1.323 -0.577 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.261 179.797 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 38.8 ttm . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.837 0.351 . . . . 0.0 110.452 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.411 ' O ' ' OG1' ' A' ' 147' ' ' THR . 43.5 tp10 -67.16 -35.07 78.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.73 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.58 -31.58 69.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.725 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -69.05 -47.95 64.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.148 0.499 . . . . 0.0 110.815 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -67.24 -38.13 84.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.721 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 10.2 m -58.55 -43.27 89.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.113 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.5 mtt -61.41 -46.4 90.29 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.04 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.6 mp -65.71 -45.85 81.21 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 119.622 -0.831 . . . . 0.0 110.466 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 64.9 t -60.53 -42.54 91.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 27.1 mt -60.01 -42.59 94.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.036 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.73 -43.74 95.62 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.174 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.489 ' CD1' ' HZ1' ' A' ' 157' ' ' LYS . 38.0 tp -60.72 -42.31 97.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.0 mt -61.25 -43.43 98.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.049 0.452 . . . . 0.0 110.158 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.41 -44.09 95.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.054 179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.23 -35.46 76.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . 0.489 ' HZ1' ' CD1' ' A' ' 153' ' ' LEU . 26.8 mmtm -60.27 -48.99 79.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.044 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -67.31 -40.75 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.022 0.439 . . . . 0.0 110.897 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 71.1 t -67.71 -44.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.535 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.75 96.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.573 ' HG ' ' H ' ' A' ' 162' ' ' HIS . 25.8 t -173.51 179.2 2.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.351 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.573 ' H ' ' HG ' ' A' ' 161' ' ' SER . 82.3 m-70 -128.42 143.94 51.07 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.063 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.4 p -78.36 150.05 76.37 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.607 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.48 156.34 61.67 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.26 1.974 . . . . 0.0 112.012 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 72.3 m . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.381 179.596 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.474 ' CD1' ' N ' ' A' ' 167' ' ' LEU . 9.0 mp . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.022 0.439 . . . . 0.0 110.088 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.45 -42.64 99.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.14 -45.79 86.96 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.996 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.69 -44.53 96.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.467 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.88 -41.9 92.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.284 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.96 -48.71 80.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.612 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.8 m -59.3 -46.73 87.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.078 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.6 m -52.94 -43.11 66.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.986 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.4 t -61.04 -44.98 99.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.366 179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 . . . . . 0 C--N 1.331 -0.236 0 CA-C-O 121.024 0.44 . . . . 0.0 110.464 179.295 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 N--CA 1.462 0.137 0 CA-C-O 120.816 0.341 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.47 -45.65 93.37 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 18.9 m -58.0 -46.64 84.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.855 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -54.19 -41.97 69.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.61 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 70.9 t -60.3 -50.83 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.284 -0.567 . . . . 0.0 110.246 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -67.85 -33.83 75.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.274 0.559 . . . . 0.0 110.475 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 35.2 t -58.04 -44.08 87.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.172 -179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 80' ' ' GLU . 60.5 m . . . . . 0 CA--C 1.52 -0.183 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 68.0 -38.43 0.36 Allowed 'General case' 0 CA--C 1.528 0.115 0 O-C-N 123.495 0.497 . . . . 0.0 110.738 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.557 ' H ' ' C ' ' A' ' 78' ' ' SER . 16.5 mm-40 -64.81 -33.74 76.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.276 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -58.22 -30.79 66.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.342 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.13 -45.95 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.874 0.369 . . . . 0.0 110.187 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.406 HD13 HG23 ' A' ' 83' ' ' ILE . 93.5 mt -65.12 -42.1 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.507 179.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -56.49 -44.57 80.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.478 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -64.67 -41.53 96.02 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 110.528 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 80.4 mt -60.14 -41.73 87.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.208 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.141 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 75.8 mtp85 -54.63 -45.74 73.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.431 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -63.69 -49.93 71.2 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.387 0.613 . . . . 0.0 110.232 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.1 -32.56 73.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.903 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -65.58 -36.33 83.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.264 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -63.56 -52.04 62.79 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.229 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.02 -26.37 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.415 0.626 . . . . 0.0 110.715 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.21 -38.56 10.95 Favored Glycine 0 N--CA 1.466 0.644 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.66 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.6 t70 -78.75 -44.07 24.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.415 0.15 . . . . 0.0 111.045 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 5.0 m -77.02 121.47 23.56 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.086 0.469 . . . . 0.0 110.809 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 94.0 mmm -140.38 19.45 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -63.23 -38.92 93.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.725 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -61.51 -40.41 94.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.651 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 CA--C 1.516 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 -179.951 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.8 mp . . . . . 0 C--O 1.226 -0.176 0 CA-C-O 120.745 0.307 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.477 ' CG1' ' N ' ' A' ' 107' ' ' ASN . 9.9 p -55.51 -43.34 72.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.98 0.419 . . . . 0.0 110.525 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.477 ' N ' ' CG1' ' A' ' 106' ' ' VAL . 65.8 t30 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.633 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -60.34 -34.81 86.48 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 17.2 mt -61.55 -42.3 98.63 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.481 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.51 -39.16 70.14 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.371 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.2 mt -67.78 -38.19 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.848 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -59.12 -40.6 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.151 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.13 -42.56 99.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.923 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 67.7 ttt-85 -78.43 -42.1 31.04 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.038 0.447 . . . . 0.0 110.677 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -48.78 -31.78 7.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.833 -178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.585 179.26 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 42.8 t0 . . . . . 0 N--CA 1.449 -0.494 0 CA-C-O 120.367 0.127 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 51.5 mt -66.75 -34.99 79.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.835 0.35 . . . . 0.0 111.019 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -36.12 63.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.797 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 72.4 m -61.23 -46.76 89.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.446 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.53 89.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.581 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.37 -42.88 99.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.638 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -62.61 -48.94 77.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.668 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -58.86 -43.14 90.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.425 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 46.2 tp -63.57 -46.92 83.68 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.325 -0.55 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.43 -37.75 76.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.294 0.569 . . . . 0.0 110.59 -178.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 . . . . . 0 C--N 1.317 -0.809 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.416 -179.94 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 38.1 ttm . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.905 0.383 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -68.38 -33.9 75.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -61.74 -34.83 76.52 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -69.87 -38.91 76.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.575 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -68.32 -39.98 81.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.964 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 85.4 m -60.12 -43.01 95.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.312 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.1 tpp -60.27 -46.82 88.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.227 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.02 -46.5 71.05 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.5 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 67.9 t -62.26 -41.89 93.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.402 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 47.9 tp -58.28 -45.79 87.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.12 -39.78 93.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.976 0.417 . . . . 0.0 110.266 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 44.3 tp -60.39 -41.22 93.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.83 -44.43 96.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.116 0.484 . . . . 0.0 110.068 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.01 -45.4 92.52 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.213 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.07 -35.81 78.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.549 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -60.31 -47.45 85.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.489 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.23 -39.23 94.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.065 0.46 . . . . 0.0 110.428 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 78.0 t -68.35 -43.17 84.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.557 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.25 99.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.333 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 46.3 t -156.24 154.74 31.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 110.548 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -81.96 -35.8 28.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.611 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 m 64.95 84.38 0.18 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.224 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.97 147.61 62.4 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 122.725 2.283 . . . . 0.0 112.232 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.469 -179.953 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 61.3 mt . . . . . 0 N--CA 1.462 0.154 0 CA-C-O 121.198 0.523 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -60.84 -43.93 97.64 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.372 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -70.01 -43.88 70.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.036 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.05 -46.73 95.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.603 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -65.01 -37.06 86.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.727 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -59.69 -49.42 77.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.302 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.3 m -59.58 -46.13 89.85 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.863 0.363 . . . . 0.0 110.371 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.0 m -53.22 -43.8 67.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.44 -43.17 97.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.772 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 120.944 0.402 . . . . 0.0 110.842 179.947 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 10.9 mp . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 120.552 0.215 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -50.74 -45.03 58.59 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.128 -177.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.6 m -62.32 -50.41 71.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.14 0.495 . . . . 0.0 110.456 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -65.35 -36.94 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.729 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 40.4 t -61.46 -46.29 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.493 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -60.61 -53.61 55.39 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.146 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 47.9 m -58.71 -40.19 82.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.872 0.368 . . . . 0.0 110.432 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 25.4 mt . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.59 179.982 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.523 -0.082 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -120.82 -46.94 2.32 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.545 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.63 -41.59 88.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.748 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.37 -39.36 94.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.0 mm -61.36 -44.16 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.232 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.0 mt -61.9 -41.74 91.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.179 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -59.88 -40.39 88.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.76 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -66.65 -52.46 44.75 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.807 0.337 . . . . 0.0 110.943 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.9 -38.31 72.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.017 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.99 -51.75 68.71 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.226 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -54.32 -48.95 70.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.44 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -66.94 -45.16 78.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.398 0.618 . . . . 0.0 110.245 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.538 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.3 tt -59.65 -40.66 88.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.273 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.89 -46.92 86.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.382 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.03 -52.18 65.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.27 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.5 t -74.51 -25.99 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.429 0.633 . . . . 0.0 110.719 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.538 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.33 -24.1 76.88 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.862 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.496 ' O ' ' CB ' ' A' ' 96' ' ' SER . 99.6 m-20 -72.58 -46.82 52.45 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.921 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.496 ' CB ' ' O ' ' A' ' 95' ' ' ASP . 1.8 m 158.23 -79.54 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.64 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.438 ' O ' ' O ' ' A' ' 96' ' ' SER . 24.7 mmm 57.87 121.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.453 -179.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 53.21 21.47 2.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.545 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -138.83 -32.49 0.68 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.481 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.955 179.877 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.447 ' CD1' ' N ' ' A' ' 105' ' ' LEU . 9.1 mp . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 120.867 0.365 . . . . 0.0 110.708 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 9.1 p -54.86 -39.01 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.188 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.531 ' OD1' ' N ' ' A' ' 108' ' ' GLY . 45.0 p-10 -58.63 -29.73 66.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.341 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.531 ' N ' ' OD1' ' A' ' 107' ' ' ASN . . . -69.71 -50.38 30.9 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.489 ' CD1' ' N ' ' A' ' 109' ' ' LEU . 8.7 mp -63.0 -42.38 99.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.929 0.395 . . . . 0.0 110.434 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.94 -49.04 76.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.629 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 72.2 mt -71.01 -44.04 66.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.919 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.3 tm0? -57.63 -41.2 80.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.12 -43.9 97.82 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 119.809 -0.756 . . . . 0.0 110.142 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 84.2 mtt85 -71.87 -28.71 63.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.047 0.451 . . . . 0.0 110.268 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -62.87 -38.09 89.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.738 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 -179.356 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.9 t0 . . . . . 0 C--O 1.232 0.134 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.2 mt -51.24 -33.43 28.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -49.36 69.73 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.435 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.4 m -61.69 -43.15 99.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.99 78.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.429 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -59.49 -41.64 90.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.56 -50.19 72.31 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.163 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -55.33 -45.54 76.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.449 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.56 -47.82 82.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.019 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.39 -41.23 79.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.7 -177.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.126 -179.649 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 18.3 tpp . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.665 0.269 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.81 -37.25 86.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.842 0.353 . . . . 0.0 110.756 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -60.54 -38.17 83.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.09 0.471 . . . . 0.0 111.156 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -75.96 -34.54 59.83 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.621 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.554 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 18.8 m -62.1 -44.11 97.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.536 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 19.1 mtm -61.67 -44.03 97.74 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.5 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.8 mt -67.91 -49.57 61.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 78.2 t -62.56 -43.2 98.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.378 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 49.8 tp -58.98 -45.46 90.54 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.439 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.03 -42.53 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.043 0.449 . . . . 0.0 110.275 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 24.2 tp -59.16 -41.85 89.36 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.115 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.4 -44.32 97.35 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.545 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.26 -46.61 82.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.356 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.26 -43.98 80.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.102 0.477 . . . . 0.0 110.43 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.56 -38.7 91.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.128 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -60.52 -41.27 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.321 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 88.5 t -66.38 -45.11 90.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.559 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.15 -35.34 80.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.05 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 35.9 p -157.73 160.93 38.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.198 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.461 ' O ' ' O ' ' A' ' 163' ' ' THR . 55.2 m80 -128.39 50.05 2.12 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.369 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' THR . . . . . 0.461 ' O ' ' O ' ' A' ' 162' ' ' HIS . 14.4 p 56.95 147.84 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.0 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.433 ' O ' ' CB ' ' A' ' 165' ' ' SER . 56.8 Cg_endo -70.74 -91.01 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.64 0 C-N-CA 122.153 1.902 . . . . 0.0 111.75 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.6 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 121.112 0.482 . . . . 0.0 110.348 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.518 ' CD2' ' N ' ' A' ' 167' ' ' LEU . 3.9 mm? . . . . . 0 CA--C 1.523 -0.09 0 CA-C-O 121.058 0.456 . . . . 0.0 110.806 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.09 -43.81 73.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.876 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -66.76 -46.93 73.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.028 0.442 . . . . 0.0 110.913 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.5 -44.27 94.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.421 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -61.49 -37.62 84.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.486 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.68 -49.71 76.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.411 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.2 m -59.13 -42.51 90.81 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.53 -42.47 87.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.224 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.6 t -61.76 -37.99 79.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.471 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 120.867 0.365 . . . . 0.0 110.359 -179.609 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 5.1 tp . . . . . 0 CA--C 1.523 -0.082 0 CA-C-O 120.953 0.406 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -51.81 -30.84 24.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.224 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 75.3 m -59.32 -51.42 70.01 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.836 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -70.6 -43.77 68.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.067 0.461 . . . . 0.0 110.889 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 69.6 t -64.35 -43.9 97.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.572 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.57 -45.2 92.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.562 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 37.6 m -59.22 -31.95 69.51 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.351 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.47 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.181 -179.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.4 ' C ' ' H ' ' A' ' 80' ' ' GLU . 12.3 t . . . . . 0 N--CA 1.458 -0.059 0 CA-C-O 120.523 0.202 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 70.88 -49.04 0.67 Allowed 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.463 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.4 ' H ' ' C ' ' A' ' 78' ' ' SER . 48.1 mt-10 -69.36 -33.78 73.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.932 0.396 . . . . 0.0 110.871 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 81' ' ' ASP . 60.0 t0 -47.66 -32.0 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.634 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.483 ' CG2' ' N ' ' A' ' 83' ' ' ILE . 15.2 tt -61.39 -43.81 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.428 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.483 ' N ' ' CG2' ' A' ' 82' ' ' ILE . 96.6 mt -65.01 -43.54 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.138 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -50.7 -53.68 29.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.192 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -61.09 -42.08 97.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.598 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.6 mt -60.32 -52.02 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.064 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.24 93.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.194 0.521 . . . . 0.0 110.294 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -54.96 -45.57 74.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.196 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -65.22 -39.55 92.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mt -66.68 -37.97 85.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.422 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.82 -47.74 79.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.173 0.511 . . . . 0.0 110.19 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -62.12 -52.23 64.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -65.5 -27.49 41.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.355 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -64.1 -32.95 85.9 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.41 -44.4 92.86 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.578 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.4 p -161.62 89.54 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.917 0.389 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.5 mtm -60.94 -49.75 76.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.27 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.63 ' C ' ' H ' ' A' ' 100' ' ' SER . 67.8 t0 -176.85 123.81 0.15 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.312 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.6 mtm180 -55.41 1.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.63 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.6 t . . . . . 0 N--CA 1.451 -0.379 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.601 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.509 ' CD1' ' N ' ' A' ' 105' ' ' LEU . 7.5 mp . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.042 0.449 . . . . 0.0 110.283 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 90.9 t -50.47 -41.7 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.946 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -57.72 -48.31 79.96 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.284 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.49 -51.1 58.65 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.92 -41.2 99.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.005 0.431 . . . . 0.0 110.121 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.69 -39.96 78.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.066 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.55 -44.29 96.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.516 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -68.01 -48.22 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.567 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 tp -61.35 -23.06 65.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.627 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -74.13 -43.99 55.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.795 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -63.23 -41.55 99.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.922 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.348 179.972 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 120.436 0.16 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.515 ' N ' ' CD2' ' A' ' 127' ' ' LEU . 4.0 mm? -71.63 -43.45 66.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.041 0.448 . . . . 0.0 110.855 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.6 70.18 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.445 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 96.7 m -57.47 -51.49 69.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.356 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.21 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.04 0.448 . . . . 0.0 110.604 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.68 -47.02 82.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.411 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -56.2 -41.84 76.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.284 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -58.24 -45.46 87.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.8 -47.21 75.86 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.231 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.37 -33.76 76.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.628 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.114 179.958 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.8 mtm . . . . . 0 N--CA 1.463 0.196 0 CA-C-O 120.817 0.342 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.467 ' CG ' ' N ' ' A' ' 144' ' ' LYS . 10.1 pt-20 -51.3 -46.35 62.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.424 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . 0.467 ' N ' ' CG ' ' A' ' 143' ' ' GLU . 88.1 tttt -62.88 -48.56 78.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.258 0.551 . . . . 0.0 109.985 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.82 -46.8 77.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.865 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 33.7 mtpt -65.98 -39.47 90.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.783 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 76.8 m -59.94 -47.8 84.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.749 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 74.1 mtm -61.4 -42.12 98.22 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.533 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.54 -43.33 85.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.809 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 64.6 t -67.97 -50.51 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.391 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.87 -44.2 96.74 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.001 0.429 . . . . 0.0 110.773 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.51 -37.74 88.48 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.19 -40.65 96.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.508 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.7 -49.46 77.42 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.789 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . 0.424 ' N ' ' CD2' ' A' ' 155' ' ' LEU . 4.1 mm? -65.32 -43.4 91.13 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.715 179.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.43 -42.9 82.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.343 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -67.52 -36.73 81.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.344 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.13 -41.97 97.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.551 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 75.5 t -63.62 -45.35 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.681 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -59.62 -51.15 71.06 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.119 -0.633 . . . . 0.0 110.01 -179.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.44 ' O ' ' C ' ' A' ' 162' ' ' HIS . 17.5 t 35.02 -120.55 0.11 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.296 0.373 . . . . 0.0 110.631 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.44 ' C ' ' O ' ' A' ' 161' ' ' SER . 78.9 m-70 31.75 78.78 0.03 OUTLIER 'General case' 0 C--N 1.341 0.217 0 O-C-N 123.216 0.322 . . . . 0.0 111.555 178.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' THR . . . . . 0.437 ' CG2' ' HE ' ' A' ' 168' ' ' ARG . 17.9 m -129.61 80.58 71.51 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.237 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.97 149.88 67.78 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.904 2.403 . . . . 0.0 111.959 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 13.6 p . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.763 179.941 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 51.5 tp . . . . . 0 N--CA 1.455 -0.224 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.437 ' HE ' ' CG2' ' A' ' 163' ' ' THR . 99.8 mtt180 -66.59 -37.88 85.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.691 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.52 -47.0 88.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.72 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.421 ' O ' ' OG1' ' A' ' 174' ' ' THR . 80.8 t -68.37 -43.15 84.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.298 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -58.4 -46.68 85.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.691 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . 0.403 ' CD2' ' O ' ' A' ' 168' ' ' ARG . 72.1 m-70 -65.03 -48.81 72.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.943 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.97 -45.92 89.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 24.4 m -53.35 -44.82 68.83 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.152 0.501 . . . . 0.0 110.214 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.73 -43.13 90.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.421 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 -179.332 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . 0.461 ' CD1' ' N ' ' A' ' 182' ' ' LEU . 9.7 mp . . . . . 0 CA--C 1.527 0.061 0 CA-C-O 120.803 0.335 . . . . 0.0 110.518 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -53.03 -32.69 48.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.613 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 20.2 m -57.22 -47.67 80.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.962 0.411 . . . . 0.0 110.6 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -67.55 -35.58 79.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.531 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 88.2 t -64.77 -43.9 96.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.549 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 87.8 mtm180 -60.34 -48.99 79.38 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.552 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 67.0 m -61.43 -42.36 98.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.851 0.358 . . . . 0.0 110.637 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 4.9 tp . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.578 -179.85 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.408 ' C ' ' H ' ' A' ' 80' ' ' GLU . 46.1 t . . . . . 0 N--CA 1.46 0.05 0 CA-C-O 120.775 0.321 . . . . 0.0 110.654 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -58.61 -8.39 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.567 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.408 ' H ' ' C ' ' A' ' 78' ' ' SER . 81.3 tt0 -62.23 -36.77 83.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.396 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -60.21 -48.29 82.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.432 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.3 mt -66.44 -43.68 90.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.447 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.31 -43.63 98.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.238 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 78.6 ttt-85 -56.09 -48.04 76.87 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -60.79 -42.74 98.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.038 0.447 . . . . 0.0 110.658 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.413 HD11 HG23 ' A' ' 86' ' ' ILE . 82.9 mt -60.52 -45.38 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.05 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.64 -39.04 93.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.119 0.485 . . . . 0.0 110.197 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -56.69 -48.62 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.906 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.24 -45.85 89.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.246 0.546 . . . . 0.0 110.49 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.522 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.1 mt -63.8 -39.41 94.18 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.462 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.479 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.39 -46.9 76.54 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.417 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.6 tp60 -64.53 -52.38 58.02 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.163 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.7 t -65.32 -25.96 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.392 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.16 -32.38 14.33 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.404 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.479 ' N ' ' O ' ' A' ' 91' ' ' ALA . 64.7 t0 -70.69 -46.85 62.39 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.999 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.563 ' C ' ' H ' ' A' ' 98' ' ' ASP . 57.4 m -51.34 -105.93 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.815 0.34 . . . . 0.0 110.991 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 mmt 55.38 4.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.213 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.563 ' H ' ' C ' ' A' ' 96' ' ' SER . 98.1 m-20 -76.45 -67.11 0.72 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.344 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -90.09 -30.39 17.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.632 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.9 m . . . . . 0 CA--C 1.518 -0.273 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.261 -179.931 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.55 ' N ' ' CD2' ' A' ' 105' ' ' LEU . 3.7 mm? . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 120.946 0.403 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.456 ' CG1' ' N ' ' A' ' 107' ' ' ASN . 14.5 p -58.96 -48.44 86.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.405 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.456 ' N ' ' CG1' ' A' ' 106' ' ' VAL . 36.3 t30 -57.46 -34.37 68.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.361 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.79 -39.66 95.27 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 51.3 tp -60.43 -42.05 95.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 110.695 -179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.82 -48.8 80.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.149 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.06 -42.26 76.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.245 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -50.84 -37.54 43.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.79 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 64.6 mt -62.33 -43.28 99.2 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.199 -0.6 . . . . 0.0 109.992 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -55.65 -41.95 74.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.0 110.03 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -63.2 -39.78 95.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.387 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 45.0 p . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.755 -179.734 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.8 t0 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 120.823 0.344 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.614 HD11 ' H ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -49.23 -28.69 4.83 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.732 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.614 ' H ' HD11 ' A' ' 127' ' ' LEU . . . -56.58 -39.58 73.75 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.14 0.495 . . . . 0.0 109.971 -178.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 88.0 m -61.79 -42.37 98.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.697 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.15 79.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.227 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -58.93 -44.91 91.45 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.385 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -67.06 -45.96 75.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.067 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -64.97 -37.0 86.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.78 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.6 tp -59.28 -54.49 46.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.362 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.77 -38.5 90.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.719 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 . . . . . 0 C--N 1.321 -0.655 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.435 -179.207 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' MET . . . . . 0.459 ' CG ' ' N ' ' A' ' 143' ' ' GLU . 12.8 ptm . . . . . 0 N--CA 1.454 -0.251 0 CA-C-O 120.94 0.4 . . . . 0.0 110.384 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 142' ' ' MET . 81.4 tt0 -66.64 -42.87 86.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.021 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.59 -29.8 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.684 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.55 -50.31 63.58 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.605 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -72.85 -30.16 63.78 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.827 -0.545 . . . . 0.0 110.819 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 68.4 m -60.24 -46.22 90.52 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.314 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 66.4 mtt -64.91 -46.58 81.1 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.581 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.5 mp -66.09 -47.29 74.73 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.032 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.51 -43.66 98.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.038 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.3 tp -53.12 -46.3 68.71 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.2 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.33 -35.98 82.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tp -59.25 -44.83 92.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.536 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.83 -44.41 96.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.048 0.451 . . . . 0.0 110.143 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.3 -43.74 90.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.055 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.69 -44.99 69.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.686 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . 0.427 ' O ' ' O ' ' A' ' 161' ' ' SER . 25.9 tptp -61.99 -40.59 96.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.572 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -62.39 -45.47 93.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.37 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.75 -43.99 82.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.687 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.94 -37.44 87.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.179 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 157' ' ' LYS . 41.1 t -172.36 176.84 3.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.275 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -128.2 142.67 51.1 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.829 0.347 . . . . 0.0 110.124 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' THR . . . . . 0.511 ' CB ' HH21 ' A' ' 168' ' ' ARG . 1.1 p -84.89 153.41 60.44 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.586 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.22 -162.38 0.1 OUTLIER 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 122.592 2.195 . . . . 0.0 111.83 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 61.6 p . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.478 -179.867 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 55.1 mt . . . . . 0 C--O 1.232 0.149 0 CA-C-O 121.017 0.437 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.511 HH21 ' CB ' ' A' ' 163' ' ' THR . 63.1 ttm-85 -60.06 -45.59 92.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.24 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.79 -46.03 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.935 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 75.6 t -63.22 -45.3 98.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.438 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -61.12 -38.23 85.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.095 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -59.75 -46.83 87.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.591 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.7 m -61.24 -46.99 88.1 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.6 m -52.59 -43.71 65.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.446 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 72.1 t -62.69 -43.41 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.292 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . 0.444 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 54.7 t-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 121.292 0.568 . . . . 0.0 110.649 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 10.9 mp . . . . . 0 N--CA 1.451 -0.417 0 CA-C-O 120.595 0.236 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 90.1 mtm-85 -51.75 -49.71 62.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.342 -178.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 96.7 m -66.78 -49.65 65.21 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.106 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -62.3 -43.89 97.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.704 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.411 ' O ' ' O ' ' A' ' 189' ' ' LEU . 46.8 t -59.59 -42.97 89.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.005 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -56.2 -53.88 51.91 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.797 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 9.9 p -62.83 -41.47 99.35 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.591 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.455 ' CD2' ' N ' ' A' ' 189' ' ' LEU . 4.2 mm? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.345 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.657 0.265 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -172.85 -73.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.36 -35.55 81.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.187 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -61.61 -41.52 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.493 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.403 HD12 HG22 ' A' ' 82' ' ' ILE . 22.1 mm -62.06 -49.06 85.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.104 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.6 -42.53 94.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.167 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -51.46 -54.59 25.34 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.882 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -53.89 -44.02 70.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.944 0.402 . . . . 0.0 110.912 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.4 -49.88 80.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 120.288 -0.565 . . . . 0.0 109.511 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.483 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -60.37 -37.69 81.53 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.948 -179.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -58.56 -47.19 85.05 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.561 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -68.88 -46.98 67.0 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.223 0.535 . . . . 0.0 110.854 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.71 -35.47 78.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.771 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.483 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -64.1 -42.74 96.78 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.408 ' NE2' ' C ' ' A' ' 92' ' ' GLN . 0.6 OUTLIER -64.05 -52.72 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.509 -179.572 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.3 p -73.67 -27.09 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.216 0.531 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -78.37 -35.8 32.36 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.74 -47.05 82.58 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.788 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.9 m -163.48 143.59 8.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.34 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 ttm -72.41 98.44 2.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.286 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.452 ' O ' ' CB ' ' A' ' 99' ' ' ARG . 66.4 t0 41.75 42.59 2.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.317 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.452 ' CB ' ' O ' ' A' ' 98' ' ' ASP . 7.9 tpt180 80.07 -74.18 0.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.307 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.7 p . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.749 -179.832 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 59.6 mt . . . . . 0 CA--C 1.523 -0.096 0 CA-C-O 120.766 0.317 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 99.3 t -61.21 -45.1 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.215 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -62.7 -41.4 99.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.92 -21.94 11.2 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.7 mt -61.53 -40.05 93.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.77 0.319 . . . . 0.0 110.579 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.14 -44.79 44.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.679 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.506 ' N ' ' CD2' ' A' ' 111' ' ' LEU . 3.9 mm? -65.67 -34.73 78.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.928 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -69.03 -47.16 66.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.388 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.99 -42.92 97.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.225 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -63.03 -46.2 88.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.195 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -70.81 -40.63 72.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.464 0.225 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.4 -179.707 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 64.4 t0 . . . . . 0 CA--C 1.519 -0.213 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.0 -40.46 91.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 120.796 0.332 . . . . 0.0 111.149 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -38.72 66.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.494 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 55.8 m -72.91 -42.77 63.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.75 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.02 87.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.079 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.9 -47.12 86.4 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.83 0.348 . . . . 0.0 110.716 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -55.07 -41.12 71.09 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.18 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -67.92 -38.47 82.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.661 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.74 -54.46 46.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.595 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.47 ' N ' ' CD1' ' A' ' 135' ' ' LEU . 8.2 mp -65.32 -40.26 93.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.012 0.434 . . . . 0.0 110.614 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.341 179.494 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 120.858 0.361 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -63.61 -34.81 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.785 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -60.9 -38.09 84.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.006 0.431 . . . . 0.0 110.241 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -62.04 -45.55 93.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.424 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.92 -32.94 74.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 19.3 m -58.92 -45.46 90.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.259 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.7 mtt -63.16 -45.98 89.32 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.658 -0.417 . . . . 0.0 109.954 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.95 -42.65 80.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 42.9 t -62.71 -43.17 98.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.285 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.27 -47.49 85.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.429 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.99 87.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.181 0.515 . . . . 0.0 109.728 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 5.6 tp -59.08 -40.77 86.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.168 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 29.1 mt -61.22 -44.73 96.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.966 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.7 -46.45 82.32 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.181 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.18 96.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.15 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -63.38 -38.94 93.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.301 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -58.17 -42.32 85.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.717 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.5 t -65.59 -46.07 90.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.281 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -69.1 -32.89 72.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.047 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 11.3 t -31.39 94.7 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.124 0.488 . . . . 0.0 110.996 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.511 ' CG ' ' O ' ' A' ' 161' ' ' SER . 89.2 m-70 -159.83 41.91 0.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.151 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' THR . . . . . 0.544 ' N ' ' CD ' ' A' ' 164' ' ' PRO . 0.5 OUTLIER -128.25 48.12 3.26 Favored Pre-proline 0 N--CA 1.466 0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.351 179.507 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 163' ' ' THR . 36.4 Cg_endo -66.1 140.71 60.73 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.503 2.136 . . . . 0.0 111.738 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.4 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.432 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 pp . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 120.983 0.42 . . . . 0.0 110.466 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -62.09 -47.09 86.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . 0.4 ' O ' ' OD1' ' A' ' 169' ' ' ASP . 66.7 t0 -66.71 -38.71 87.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.54 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 84.8 t -61.95 -46.51 96.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.586 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -61.21 -41.3 96.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.837 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.95 -49.71 76.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.501 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 85.2 m -60.07 -42.47 94.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.547 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.2 m -56.31 -43.19 78.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.435 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.0 t -61.33 -43.13 96.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.542 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.797 179.839 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 53.9 tp . . . . . 0 N--CA 1.454 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.739 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -56.73 -32.78 65.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.415 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 69.3 m -61.0 -49.07 78.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -68.91 -42.22 77.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.027 0.441 . . . . 0.0 110.316 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.98 -42.69 97.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.682 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -58.95 -44.73 91.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.298 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.3 t -61.23 -44.48 97.2 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.775 0.321 . . . . 0.0 110.518 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 50.8 tp . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.55 -179.704 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.0 m . . . . . 0 N--CA 1.465 0.31 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? 70.92 -56.52 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -65.22 -33.82 76.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.0 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -58.48 -45.4 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.525 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.46 -43.77 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.408 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.7 mt -62.41 -43.36 98.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -53.46 -53.18 55.09 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -58.1 -42.37 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.699 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.54 -51.59 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.011 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -61.81 -38.2 87.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.338 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -55.96 -47.51 77.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.607 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -66.23 -45.17 81.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.507 . . . . 0.0 110.826 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.478 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.3 mt -68.44 -33.6 74.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.471 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.46 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -58.78 -46.48 87.45 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.132 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.32 -51.99 60.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.077 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.39 -26.16 38.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.478 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.17 -22.96 42.59 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -63.13 -43.85 97.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.703 0.287 . . . . 0.0 111.077 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.589 ' C ' ' H ' ' A' ' 98' ' ' ASP . 32.7 t -165.83 -75.88 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.581 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.9 tpt 66.67 -14.25 0.16 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.358 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.589 ' H ' ' C ' ' A' ' 96' ' ' SER . 95.1 m-20 -72.03 -19.45 61.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.219 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -68.89 -41.22 78.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.68 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 77.0 p . . . . . 0 CA--C 1.515 -0.4 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.731 -179.771 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.9 mp . . . . . 0 CA--C 1.531 0.245 0 CA-C-O 120.539 0.209 . . . . 0.0 110.484 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 69.2 t -64.92 -45.79 93.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.947 0.403 . . . . 0.0 110.249 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -64.22 -32.19 73.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.999 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -61.6 -35.25 90.86 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.03 -38.29 88.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.539 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -56.97 -47.56 80.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.385 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 5.1 tt -65.53 -46.24 80.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.586 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -50.86 -36.35 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.647 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.4 mt -61.49 -42.98 99.61 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.234 -0.586 . . . . 0.0 109.663 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -56.5 -42.54 78.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 110.151 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.86 -37.84 88.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.305 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 46.1 p . . . . . 0 N--CA 1.463 0.202 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.755 -179.993 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.7 t0 . . . . . 0 N--CA 1.449 -0.508 0 N-CA-C 110.706 -0.109 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.552 ' N ' ' CD2' ' A' ' 127' ' ' LEU . 3.6 mm? -71.49 -42.96 67.42 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.141 0.496 . . . . 0.0 111.16 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.85 -28.73 69.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.567 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 6.0 m -60.42 -49.85 75.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.154 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.14 -45.65 90.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.29 -41.99 96.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.644 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -55.33 -45.02 76.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.138 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -61.91 -47.05 86.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.726 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.4 tp -64.5 -49.12 72.58 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.456 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -31.95 67.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.231 0.539 . . . . 0.0 110.214 -178.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.681 -179.293 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.73 0.3 . . . . 0.0 110.748 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -65.23 -44.6 87.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.009 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.13 -34.15 77.72 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.148 -179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -64.92 -43.32 93.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.069 0.462 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -66.46 -36.18 82.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.582 179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 58.5 m -58.56 -43.77 89.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.262 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mmm -61.36 -46.56 89.72 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.356 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.0 -43.82 81.91 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.122 0.487 . . . . 0.0 110.673 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 47.1 t -60.68 -45.28 97.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.563 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 36.3 mt -58.13 -45.66 86.95 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.434 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.85 -40.43 91.72 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.389 -0.525 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.23 -45.28 84.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.267 -178.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.54 -44.04 97.77 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.746 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 tt -65.08 -51.66 60.14 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.031 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.68 -41.87 98.1 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.758 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -63.79 -36.73 84.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.311 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -62.32 -39.36 92.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.385 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.9 t -67.89 -49.47 68.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.668 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . 0.483 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -70.89 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.325 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.513 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 38.5 t -24.7 90.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.812 0.695 . . . . 0.0 111.186 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.513 ' CG ' ' O ' ' A' ' 161' ' ' SER . 70.3 m-70 -160.74 38.25 0.16 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.423 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 p -101.26 150.41 37.13 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.631 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.63 166.08 30.54 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 122.807 2.338 . . . . 0.0 111.782 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 N--CA 1.463 0.208 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.645 179.83 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 62.0 mt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 121.015 0.436 . . . . 0.0 110.371 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -60.59 -45.45 93.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.099 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -65.48 -42.02 92.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.583 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 83.6 t -62.3 -44.64 99.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.325 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.17 -40.61 81.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -60.69 -44.48 96.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.418 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 11.9 m -64.89 -40.24 94.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.795 0.331 . . . . 0.0 110.618 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.7 m -58.35 -50.74 72.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.984 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.9 -33.36 61.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.584 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.062 179.625 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . 0.467 ' CD1' ' N ' ' A' ' 182' ' ' LEU . 9.8 mp . . . . . 0 C--O 1.223 -0.306 0 CA-C-O 120.796 0.332 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -51.79 -43.72 63.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.471 -177.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.1 m -61.86 -52.25 64.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.81 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -66.65 -41.65 87.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.004 0.431 . . . . 0.0 110.965 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 74.6 t -64.19 -43.44 97.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.554 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -57.68 -52.52 65.11 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.449 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 57.1 m -58.48 -49.04 78.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.701 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 49.2 tp . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.425 179.542 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.895 0.378 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -63.58 -37.2 86.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.372 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -60.31 -36.77 78.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.33 -49.71 75.9 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.875 0.369 . . . . 0.0 110.661 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 94.3 mt -64.54 -43.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.284 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.03 -43.27 97.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.787 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttm-85 -53.43 -53.69 47.63 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -58.0 -44.0 86.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.031 0.443 . . . . 0.0 110.632 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 93.1 mt -61.43 -50.47 80.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.563 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.09 -39.92 83.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.515 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 62.1 ttt85 -54.4 -45.71 72.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.034 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -63.31 -44.62 94.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.484 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.2 mt -64.66 -39.25 93.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.558 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.85 -44.56 74.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.117 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -64.51 -51.77 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.31 179.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -26.29 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.665 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.11 -19.79 56.64 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -62.74 -46.88 86.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.775 0.321 . . . . 0.0 110.536 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.0 m -77.41 -69.87 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.865 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.412 ' HG2' ' H ' ' A' ' 98' ' ' ASP . 3.4 ttp -76.93 -177.66 4.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.13 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.412 ' H ' ' HG2' ' A' ' 97' ' ' MET . 98.6 m-20 55.75 36.37 27.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.764 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -105.81 2.04 27.44 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.643 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 120.933 0.397 . . . . 0.0 110.883 -179.817 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 N--CA 1.462 0.148 0 CA-C-O 120.815 0.34 . . . . 0.0 110.579 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.7 m -64.17 -43.75 97.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.271 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -64.62 -50.56 66.68 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.966 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -63.08 -31.44 80.72 Favored Glycine 0 CA--C 1.522 0.507 0 N-CA-C 110.739 -0.945 . . . . 0.0 110.739 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.6 -48.45 81.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -47.74 84.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.443 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.22 -45.75 86.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.123 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.44 ' O ' ' OD1' ' A' ' 115' ' ' ASN . 58.1 tt0 -61.73 -35.31 77.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.031 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.2 tp -64.23 -33.42 75.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.392 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . 0.464 ' C ' ' H ' ' A' ' 116' ' ' THR . 61.3 ttp180 -60.0 -40.76 90.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.741 -179.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 116' ' ' THR . 33.1 p-10 -48.82 -13.96 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.668 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.464 ' H ' ' C ' ' A' ' 114' ' ' ARG . 99.5 m . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.692 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 39.2 t70 . . . . . 0 CA--C 1.522 -0.116 0 CA-C-O 120.617 0.246 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 pp -59.75 -31.66 69.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.702 0.286 . . . . 0.0 110.837 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.14 -40.35 70.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.18 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 27.0 m -60.79 -50.7 72.41 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.102 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.5 73.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.245 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.64 -46.23 89.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.137 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.28 -47.93 59.01 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.625 -0.43 . . . . 0.0 109.991 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -59.82 -43.55 94.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.671 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 5.7 tt -64.14 -41.27 97.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.978 0.418 . . . . 0.0 110.703 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -27.69 46.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 . . . . . 0 C--N 1.323 -0.578 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.023 -179.433 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 39.0 ttm . . . . . 0 N--CA 1.473 0.707 0 CA-C-O 120.98 0.419 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -66.06 -48.09 72.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.282 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -63.69 -36.46 83.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.143 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -71.32 -45.95 61.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.882 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -57.78 -49.45 76.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.419 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 3.5 m -64.41 -50.24 68.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.007 0.432 . . . . 0.0 110.514 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 21.8 ttp -62.13 -34.88 77.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.65 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 46.1 tp -59.67 -48.25 82.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.188 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.52 -43.96 95.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.568 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 56.7 tp -61.38 -45.88 92.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.379 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.92 73.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.405 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.4 tp -66.47 -39.39 88.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.43 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 37.6 mt -61.51 -45.83 92.55 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.466 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.95 -39.81 90.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.681 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.22 -42.19 66.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.526 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -66.72 -41.78 87.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.689 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -61.49 -45.32 94.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.575 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 69.5 t -63.42 -44.89 99.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.38 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.48 -39.23 92.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.832 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 47.0 m -164.89 164.37 20.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -122.04 134.61 54.79 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' THR . . . . . 0.475 ' OG1' ' NH2' ' A' ' 168' ' ' ARG . 0.5 OUTLIER -90.24 157.3 45.34 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 120.641 0.257 . . . . 0.0 110.541 -179.371 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 163' ' ' THR . 76.3 Cg_exo -42.19 170.05 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.411 2.074 . . . . 0.0 111.959 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 79.9 p . . . . . 0 N--CA 1.466 0.331 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.623 179.796 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' A' ' 167' ' ' LEU . 10.8 mp . . . . . 0 N--CA 1.463 0.182 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.504 ' O ' ' ND1' ' A' ' 172' ' ' HIS . 9.7 ptp180 -71.17 -34.44 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.608 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -62.31 -46.89 86.72 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.96 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.479 ' O ' ' OG1' ' A' ' 173' ' ' THR . 7.5 p -69.97 -33.28 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.133 0.492 . . . . 0.0 110.119 179.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -59.16 -46.28 88.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.115 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . 0.504 ' ND1' ' O ' ' A' ' 168' ' ' ARG . 72.0 m80 -65.32 -42.24 93.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' THR . . . . . 0.479 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 51.9 p -58.21 -46.09 86.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.348 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' THR . . . . . 0.467 ' N ' ' HG1' ' A' ' 173' ' ' THR . 76.8 m -59.63 -44.63 93.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.917 0.389 . . . . 0.0 110.341 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.79 -44.28 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.481 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.334 -179.15 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -59.11 -37.58 77.52 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.209 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -60.55 -46.99 88.15 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.392 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -64.0 -35.59 81.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 62.0 t -59.82 -45.62 94.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.213 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.45 -49.9 73.58 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.691 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.5 t -59.96 -41.68 92.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.442 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.491 ' N ' ' CD2' ' A' ' 189' ' ' LEU . 3.8 mm? . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.687 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.2 m . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.877 0.37 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? 72.08 -64.61 0.38 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.311 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -65.3 -47.0 78.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.574 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -65.88 -33.96 77.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.353 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.68 -43.37 98.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.857 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.44 -43.84 98.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.201 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.62 -55.49 23.2 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -53.2 -46.25 68.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.3 mm -62.15 -45.58 98.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 179.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -50.88 -35.08 31.02 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.826 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.8 mmt-85 -66.15 -50.01 65.44 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.815 0.34 . . . . 0.0 110.091 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -69.44 -50.42 45.8 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.109 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 94' ' ' GLY . 1.3 tt -53.88 -41.68 67.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.004 0.431 . . . . 0.0 109.853 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.95 -48.51 81.51 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.922 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -64.47 -51.94 60.51 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.412 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.1 p -68.62 -31.84 52.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 109.894 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -60.23 -34.25 83.64 Favored Glycine 0 CA--C 1.519 0.292 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.41 -47.56 84.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.129 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.3 m -114.01 111.78 22.21 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.132 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 79.7 mtp -85.38 -102.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 43.9 t0 50.99 18.99 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.601 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -140.58 -53.46 0.5 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.2 p . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.25 -179.945 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.513 ' CD1' ' N ' ' A' ' 105' ' ' LEU . 6.4 mp . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.751 0.31 . . . . 0.0 110.735 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.414 ' CG2' ' N ' ' A' ' 107' ' ' ASN . 33.7 m -59.3 -50.4 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.913 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.414 ' N ' ' CG2' ' A' ' 106' ' ' VAL . 20.6 t-20 -57.36 -46.65 83.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.228 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.5 -42.57 95.67 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.083 -1.207 . . . . 0.0 110.083 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 tp -59.42 -40.84 88.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.78 -37.44 87.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.6 tp -61.74 -48.75 79.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.866 0.365 . . . . 0.0 111.27 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.555 ' O ' ' N ' ' A' ' 116' ' ' THR . 16.4 pt20 -71.92 -45.17 62.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.033 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.99 -25.79 65.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.3 -179.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -79.33 -49.2 12.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.54 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -89.35 -56.71 3.15 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.053 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.555 ' N ' ' O ' ' A' ' 112' ' ' GLN . 1.7 m . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.031 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 42.4 t0 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 120.674 0.273 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.31 -41.26 70.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.124 0.488 . . . . 0.0 111.175 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.77 -28.58 70.08 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.791 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 96.6 m -59.67 -52.68 64.47 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.099 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.16 -47.34 74.33 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.817 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 30.5 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.379 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -53.6 -39.04 64.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.919 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -64.17 -36.55 84.41 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.562 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.64 -48.94 78.6 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.545 -178.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.439 ' CD2' ' N ' ' A' ' 135' ' ' LEU . 4.2 mm? -61.3 -29.76 70.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.435 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.279 179.916 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 2.5 ttt . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.874 0.369 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.403 ' O ' ' OG1' ' A' ' 147' ' ' THR . 81.3 tt0 -65.36 -35.43 80.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.599 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -63.37 -40.99 98.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.776 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.475 ' OE1' ' N ' ' A' ' 145' ' ' GLU . 57.9 mp0 -67.7 -52.45 37.59 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.794 -0.762 . . . . 0.0 109.51 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -53.15 -38.76 63.02 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.555 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 16.8 m -61.85 -43.31 99.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.511 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 50.6 mtt -62.66 -39.42 93.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.747 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.437 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.6 t -61.69 -42.3 93.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.281 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.41 -44.99 92.76 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.203 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.08 -31.5 72.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.818 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.74 -39.96 69.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.43 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 16.3 mt -60.87 -42.14 97.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.039 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.35 -49.79 74.15 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.667 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.8 -36.04 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.621 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -62.27 -45.66 92.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.583 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.13 -41.39 98.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.768 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.7 t -61.51 -46.65 96.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.485 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.41 -48.81 76.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.971 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 37.2 t -162.94 158.98 23.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.456 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -134.21 133.14 40.55 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.933 0.397 . . . . 0.0 110.429 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.12 155.0 80.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.322 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.51 -19.4 54.8 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.627 2.218 . . . . 0.0 111.867 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' SER . . . . . 0.518 ' O ' ' N ' ' A' ' 167' ' ' LEU . 7.7 t . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.256 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 165' ' ' SER . 47.5 mt . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.889 0.376 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -62.55 -43.51 98.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -63.25 -44.14 96.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.651 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.451 ' O ' ' OG1' ' A' ' 173' ' ' THR . 71.0 t -63.41 -47.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.881 0.372 . . . . 0.0 110.398 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.07 -47.0 86.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.439 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -64.26 -40.34 95.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' THR . . . . . 0.451 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 8.9 p -62.94 -43.76 97.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.607 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.7 m -61.97 -50.46 72.02 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.473 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.6 t -62.08 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.213 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 -179.728 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 53.7 tp . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.505 0.193 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -51.45 -34.96 37.57 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.572 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -66.03 -50.59 63.69 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -61.83 -47.97 82.69 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.022 0.439 . . . . 0.0 111.686 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 23.0 m -66.59 -32.97 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.253 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -59.67 -48.99 79.48 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.506 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.6 t -61.41 -42.75 99.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.76 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.365 -179.894 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.465 0.308 0 CA-C-O 121.067 0.461 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -65.33 -34.16 77.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.67 -33.74 76.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -61.91 -35.6 78.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.068 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 95.6 mt -62.48 -45.42 98.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.216 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.99 -41.55 89.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.241 0.543 . . . . 0.0 110.388 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -69.12 -44.62 72.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.435 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -61.12 -56.18 23.88 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.035 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.419 ' CG2' ' N ' ' A' ' 87' ' ' ALA . 18.8 tt -61.47 -41.19 89.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.441 0.639 . . . . 0.0 109.756 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.419 ' N ' ' CG2' ' A' ' 86' ' ' ILE . . . -51.02 -40.21 57.67 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -68.58 -44.38 74.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.34 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -62.83 -50.34 71.34 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.8 mt -52.13 -39.82 60.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.126 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.96 -49.04 79.07 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.857 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.74 -50.77 55.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.284 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 87.3 t -60.23 -42.32 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.193 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -53.96 -43.42 71.8 Favored Glycine 0 CA--C 1.519 0.335 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -76.2 -47.16 25.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.542 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.551 ' C ' ' H ' ' A' ' 98' ' ' ASP . 18.3 m -61.16 -71.8 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.532 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 73.7 mmm 66.07 -41.65 0.36 Allowed 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.693 0.621 . . . . 0.0 110.656 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.551 ' H ' ' C ' ' A' ' 96' ' ' SER . 68.2 t0 -61.88 -40.07 94.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.489 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -64.66 -43.36 93.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.401 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 51.5 m . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.381 -179.855 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.509 ' CD2' ' N ' ' A' ' 105' ' ' LEU . 3.7 mm? . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 13.8 p -70.77 -35.06 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.563 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -61.12 -40.84 95.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.509 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.13 -51.18 58.56 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 60.4 tp -62.86 -42.6 99.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.543 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.4 -48.48 81.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 tp -64.82 -45.06 87.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.742 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -67.77 -26.9 66.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.667 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.433 ' O ' ' OG1' ' A' ' 116' ' ' THR . 57.1 tp -61.51 -43.0 99.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.135 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -59.79 -34.11 72.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.836 0.351 . . . . 0.0 110.369 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -58.74 -40.37 83.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.224 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 113' ' ' LEU . 45.5 p . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.489 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.1 t0 . . . . . 0 N--CA 1.455 -0.194 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 31.8 mt -52.8 -38.24 60.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.535 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.12 -47.84 71.4 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 81.8 m -62.36 -43.75 98.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.861 0.362 . . . . 0.0 110.455 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.96 -47.5 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.537 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -61.57 -42.43 98.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.404 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -64.03 -52.71 58.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.058 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -61.33 -44.62 96.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.683 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.31 -51.12 65.05 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.4 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 41.4 tp -57.72 -38.89 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.302 -178.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.591 179.409 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 50.1 mtt . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.871 0.367 . . . . 0.0 110.642 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -67.25 -32.66 73.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.598 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -58.38 -43.34 88.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.667 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -66.49 -51.87 52.11 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -52.69 -40.9 63.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.313 -179.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.5 m -59.83 -51.49 69.5 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.758 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 78.0 mtm -68.66 -40.0 80.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.017 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 62.9 mt -63.61 -43.18 97.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.691 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 40.9 t -60.78 -44.73 98.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.217 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 54.4 tp -61.02 -46.74 89.51 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.51 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.43 -35.91 81.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.5 tp -70.28 -35.68 73.9 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.929 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -45.96 92.47 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.868 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.32 -46.06 91.84 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.313 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.2 -45.18 74.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.535 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -64.25 -36.54 84.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.339 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.29 -47.17 86.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.276 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 96.0 t -64.93 -45.26 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.708 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -57.36 -48.55 78.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.26 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.506 ' C ' ' CG ' ' A' ' 162' ' ' HIS . 97.9 p -110.13 -133.11 0.33 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.559 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.506 ' CG ' ' C ' ' A' ' 161' ' ' SER . 0.1 OUTLIER -179.99 165.78 1.23 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.974 0.416 . . . . 0.0 109.953 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 4.6 p -73.02 149.76 89.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.65 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.68 -88.27 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.528 2.152 . . . . 0.0 112.307 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' SER . . . . . 0.49 ' O ' ' NE ' ' A' ' 168' ' ' ARG . 15.7 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.607 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 50.4 mt . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.699 0.285 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.497 ' CG ' ' N ' ' A' ' 169' ' ' ASP . 14.8 ptp180 -60.95 -45.61 94.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.519 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . 0.497 ' N ' ' CG ' ' A' ' 168' ' ' ARG . 67.1 t0 -65.26 -40.76 94.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.68 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.9 t -61.37 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.305 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -57.09 -47.29 81.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.46 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . 0.663 ' CD2' HD22 ' A' ' 176' ' ' ASN . 73.5 t60 -61.55 -37.02 82.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.22 0.533 . . . . 0.0 110.142 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 79.4 m -65.78 -43.23 89.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.764 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 96.3 m -58.44 -52.36 65.95 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.939 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.4 p -60.66 -38.17 77.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.06 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . 0.663 HD22 ' CD2' ' A' ' 172' ' ' HIS . 92.5 m-20 . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.153 0 CA-C-O 121.077 0.465 . . . . 0.0 110.502 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -57.18 -46.71 82.58 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.21 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 15.3 m -57.23 -43.3 82.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.328 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -66.05 -34.18 77.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.007 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 43.7 t -59.91 -48.55 87.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.559 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -62.28 -52.73 62.55 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.147 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 96.5 p -57.99 -22.05 47.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.767 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.352 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.0 m . . . . . 0 CA--C 1.522 -0.1 0 CA-C-O 121.002 0.43 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -52.3 -29.63 24.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.588 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.26 -38.98 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.44 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.06 -43.54 98.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.424 HG21 HD11 ' A' ' 82' ' ' ILE . 87.9 mt -63.02 -43.16 98.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.615 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.1 mt -61.34 -42.4 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -54.01 -54.69 35.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -54.79 -40.17 69.19 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.687 0.279 . . . . 0.0 110.427 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.0 mm -64.49 -46.36 92.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.323 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.7 90.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.649 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -59.4 -48.96 79.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.823 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -66.79 -40.54 88.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.089 0.471 . . . . 0.0 110.118 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.542 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.2 tt -67.24 -37.43 83.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.511 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.59 -47.8 83.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.75 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -64.74 -52.17 58.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.554 -0.459 . . . . 0.0 110.153 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.88 -26.74 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.578 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -76.14 -31.28 55.61 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -61.76 -46.98 87.24 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p -66.48 -32.05 73.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.554 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 60.8 ttp -61.35 -36.18 79.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.388 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.54 -17.22 59.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.939 0.4 . . . . 0.0 110.314 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -59.38 -44.92 92.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.072 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.465 0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.139 179.547 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.457 ' O ' ' N ' ' A' ' 109' ' ' LEU . 1.8 pt? . . . . . 0 CA--C 1.527 0.079 0 CA-C-O 120.905 0.383 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 66.2 t -58.93 -46.13 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.403 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -59.87 -45.05 93.72 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.087 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -77.15 -22.66 70.54 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.457 ' N ' ' O ' ' A' ' 105' ' ' LEU . 53.4 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.325 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.04 -48.07 77.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.322 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.76 -43.36 93.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.428 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -44.86 75.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.258 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 tp -63.51 -44.64 93.7 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.388 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -51.37 -38.28 52.5 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.86 -51.55 54.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.046 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 21.0 m . . . . . 0 C--O 1.233 0.186 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.311 -179.915 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 48.9 t0 . . . . . 0 CA--C 1.519 -0.226 0 N-CA-C 110.427 -0.212 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.0 -33.5 75.87 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.55 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -44.15 71.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.087 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.8 m -60.33 -51.41 69.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.19 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.27 -46.39 80.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.159 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 36.7 tp -61.58 -43.35 99.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.567 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -62.41 -51.56 67.05 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.387 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mm-40 -60.87 -39.86 90.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.141 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.2 tp -61.55 -51.39 68.76 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.781 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.64 -38.13 80.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.299 0.571 . . . . 0.0 110.44 -177.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 . . . . . 0 C--N 1.315 -0.913 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.312 179.9 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 10.7 ptm . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.644 0.259 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -64.41 -37.89 89.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 0.0 110.141 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -64.15 -46.01 85.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.033 0.444 . . . . 0.0 110.066 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -55.28 -30.16 59.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.64 -178.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -69.13 -43.73 73.78 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.214 178.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.429 ' O ' ' CB ' ' A' ' 151' ' ' LEU . 84.2 m -69.96 -36.02 74.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.537 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.4 mtt -60.27 -46.03 91.23 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.02 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.3 mp -73.25 -50.6 21.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.43 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 79.1 t -60.56 -45.74 96.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.498 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.429 ' CB ' ' O ' ' A' ' 147' ' ' THR . 56.6 tp -58.05 -44.72 87.58 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.496 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.87 -36.7 82.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.48 ' CG ' ' HZ1' ' A' ' 157' ' ' LYS . 38.5 tp -63.67 -42.05 98.11 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.912 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.34 -42.42 95.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.414 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.22 -40.24 96.9 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.75 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.16 -39.02 69.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.269 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . 0.48 ' HZ1' ' CG ' ' A' ' 153' ' ' LEU . 31.2 mttp -62.73 -44.68 95.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.834 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.7 -44.21 97.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.457 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 80.7 t -65.48 -43.06 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.085 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . 0.442 ' C ' ' HG ' ' A' ' 161' ' ' SER . . . -60.15 -47.63 85.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.81 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.442 ' HG ' ' C ' ' A' ' 160' ' ' ALA . 74.5 m -167.89 168.12 12.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.39 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -117.92 127.04 53.47 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.989 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.46 156.91 59.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.643 -179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -69.67 157.59 60.04 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.954 2.436 . . . . 0.0 112.537 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.056 179.692 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.458 -0.075 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -59.08 -43.32 91.77 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.221 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.98 -43.28 99.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.677 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.452 ' O ' ' OG1' ' A' ' 173' ' ' THR . 96.4 t -62.88 -43.34 98.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.066 0.46 . . . . 0.0 110.221 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -56.29 -49.24 74.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -61.86 -45.35 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.544 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 19.4 p -58.37 -45.69 87.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.195 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -54.04 -45.71 71.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 110.272 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 86.0 t -61.13 -44.42 98.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.782 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.499 -179.978 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.474 0.178 . . . . 0.0 110.824 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -60.11 -45.59 92.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.245 0.545 . . . . 0.0 110.021 -179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -57.18 -44.62 83.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.809 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -58.17 -39.7 79.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.58 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.5 t -58.43 -50.2 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.035 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -68.47 -45.84 71.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.299 0.571 . . . . 0.0 110.745 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 23.6 p -58.64 -35.07 71.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.998 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 85.3 mt . . . . . 0 N--CA 1.464 0.235 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.266 179.789 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 N--CA 1.467 0.42 0 CA-C-O 120.916 0.389 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -60.66 -31.52 70.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.952 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -66.89 -36.61 82.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.449 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -61.52 -45.27 94.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.158 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.427 HG22 HD13 ' A' ' 82' ' ' ILE . 96.6 mt -65.08 -44.38 95.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.354 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 97.2 mt -66.07 -41.11 88.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.253 0.549 . . . . 0.0 110.27 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -70.61 -50.31 38.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.851 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -52.91 -55.09 25.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.303 -178.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.449 ' CG2' ' N ' ' A' ' 87' ' ' ALA . 21.0 tt -63.29 -44.61 99.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.724 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.449 ' N ' ' CG2' ' A' ' 86' ' ' ILE . . . -51.13 -39.38 56.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.955 -178.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -65.26 -49.79 68.26 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.411 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -66.94 -52.15 46.47 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 120.337 -0.545 . . . . 0.0 109.896 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.6 tt -52.84 -38.48 61.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.114 -179.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.67 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.748 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -67.76 -46.01 73.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.854 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 96' ' ' SER . 69.3 t -66.23 -40.38 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.195 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -55.78 -42.91 86.7 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -61.69 -47.48 85.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.199 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 93' ' ' VAL . 46.7 t -109.07 110.8 22.15 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.075 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.435 ' O ' ' O ' ' A' ' 98' ' ' ASP . 10.8 ttm -64.95 -11.34 37.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.924 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.488 ' O ' ' N ' ' A' ' 100' ' ' SER . 98.8 m-20 -53.29 -167.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 51.5 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.154 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 98' ' ' ASP . 48.1 t . . . . . 0 C--N 1.329 -0.312 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 77.7 mt . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.735 0.302 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -34.56 62.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.066 0.46 . . . . 0.0 110.467 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.33 -41.6 98.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.174 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.83 -42.24 59.42 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.1 tt -60.75 -48.45 81.73 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.994 0.426 . . . . 0.0 110.041 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.78 93.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.526 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.9 tt -63.31 -47.56 81.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.943 0.401 . . . . 0.0 110.165 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.86 -39.71 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.307 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.23 -42.31 99.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.402 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -64.8 -38.08 89.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.17 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.13 -37.97 75.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.155 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.497 179.925 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 64.2 t0 . . . . . 0 N--CA 1.462 0.125 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 60.2 mt -52.01 -33.13 37.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.672 0.272 . . . . 0.0 110.577 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.41 -49.62 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.817 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 15.5 m -62.95 -42.72 99.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.334 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.46 -46.92 80.13 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.0 mt -58.93 -41.26 86.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -54.94 -52.43 63.02 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.707 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -51.98 -47.91 64.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.107 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -42.89 96.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.63 -47.69 79.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.036 -178.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.214 -179.926 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.274 0 CA-C-O 121.01 0.433 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.462 ' O ' ' OG1' ' A' ' 147' ' ' THR . 82.2 tt0 -66.84 -40.96 88.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.479 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -60.84 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.199 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . 0.429 ' CG ' ' H ' ' A' ' 146' ' ' LYS . 9.7 pt-20 -72.59 -52.52 15.15 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.992 -0.683 . . . . 0.0 109.289 179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . 0.429 ' H ' ' CG ' ' A' ' 145' ' ' GLU . 64.6 tttp -52.36 -39.7 61.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.236 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.462 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 70.6 m -63.64 -44.17 94.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.617 178.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 18.9 mtm -62.89 -38.75 92.14 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.577 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.12 -41.79 99.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.076 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 75.8 t -63.39 -42.54 96.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.623 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.82 -45.26 90.38 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.195 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.41 -31.56 72.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.306 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 10.1 tp -71.98 -41.32 67.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.896 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.994 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.46 -44.09 95.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.17 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.8 -40.67 79.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.016 0.436 . . . . 0.0 110.312 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -64.2 -42.72 96.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.045 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.29 -45.12 94.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.308 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 70.5 t -62.29 -45.81 97.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.16 -41.43 97.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.767 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 28.8 t -142.97 145.14 32.69 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.366 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 35.8 m80 -68.64 -139.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.479 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 5.3 p -140.05 150.57 62.51 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.081 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.448 ' O ' ' OG ' ' A' ' 165' ' ' SER . 44.2 Cg_exo -41.96 -64.58 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 122.232 1.955 . . . . 0.0 112.565 179.557 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' SER . . . . . 0.502 ' C ' ' H ' ' A' ' 167' ' ' LEU . 1.5 m . . . . . 0 CA--C 1.533 0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.311 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.502 ' H ' ' C ' ' A' ' 165' ' ' SER . 58.0 mt . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.678 0.275 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -65.06 -42.48 94.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 0.0 110.626 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -64.87 -43.84 91.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.658 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.9 t -61.19 -45.65 98.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.097 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -57.29 -42.91 82.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.097 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -59.78 -40.57 88.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.605 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 20.1 m -59.84 -44.89 93.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -59.36 -45.93 90.04 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 110.639 -179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.09 -44.53 95.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.146 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 40.3 t30 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.541 -179.983 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.804 0.335 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -57.36 -36.88 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.5 m -59.69 -51.03 71.51 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.733 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -66.83 -39.86 87.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.113 0.482 . . . . 0.0 110.691 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.24 -39.65 83.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.332 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -61.23 -44.62 96.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.644 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 72.3 m -58.49 -38.31 77.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.361 . . . . 0.0 110.391 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 57.3 tp . . . . . 0 C--N 1.328 -0.336 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.204 179.829 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 56.2 p . . . . . 0 N--CA 1.461 0.085 0 CA-C-O 120.939 0.399 . . . . 0.0 110.683 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -47.37 -29.94 2.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.555 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -67.2 -33.87 76.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.689 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -55.72 -46.79 77.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.522 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.472 ' CD1' ' N ' ' A' ' 82' ' ' ILE . 2.0 mp -62.79 -46.04 97.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.357 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.414 HG21 HD13 ' A' ' 83' ' ' ILE . 97.2 mt -62.11 -43.04 97.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.684 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.3 ttt85 -50.97 -49.96 59.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.643 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -56.46 -43.85 79.95 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.632 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.89 -50.1 81.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.456 -0.497 . . . . 0.0 109.722 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.1 89.85 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -57.8 -48.5 79.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.67 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -66.75 -40.42 88.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.158 0.504 . . . . 0.0 110.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.526 ' O ' ' N ' ' A' ' 94' ' ' GLY . 5.9 tt -66.91 -38.87 87.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.625 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.464 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -59.97 -42.02 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.628 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -65.41 -52.51 52.82 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.921 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.5 t -69.66 -26.08 29.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.815 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.526 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -85.5 -37.36 9.71 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.224 -0.75 . . . . 0.0 111.224 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' A' ' 91' ' ' ALA . 42.7 t0 -72.05 -46.46 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.614 0.245 . . . . 0.0 110.941 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.483 ' C ' ' H ' ' A' ' 98' ' ' ASP . 70.9 m -57.62 -123.22 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.917 0.389 . . . . 0.0 111.034 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.6 ttt 62.66 1.44 0.79 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.035 0.445 . . . . 0.0 110.251 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.483 ' H ' ' C ' ' A' ' 96' ' ' SER . 43.5 t0 -62.74 -37.59 87.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.512 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -66.98 135.48 53.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.537 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 t . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.472 -179.995 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.453 ' CD1' ' N ' ' A' ' 105' ' ' LEU . 9.9 mp . . . . . 0 N--CA 1.464 0.25 0 CA-C-O 120.909 0.385 . . . . 0.0 110.296 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.36 -32.75 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.735 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.423 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 56.5 t-20 -60.32 -30.19 69.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.14 0.495 . . . . 0.0 110.518 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -64.42 -47.72 81.38 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.504 ' CD2' ' N ' ' A' ' 109' ' ' LEU . 3.5 mm? -62.91 -38.52 91.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.719 0.295 . . . . 0.0 110.708 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.99 73.31 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.236 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.6 tt -70.63 -48.09 56.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -61.79 -25.49 67.51 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.689 -179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.41 ' N ' ' O ' ' A' ' 109' ' ' LEU . 58.6 tp -60.22 -43.11 96.27 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.17 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.59 -42.64 98.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.576 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -65.46 -43.37 90.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.686 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.9 m . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.66 179.794 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.1 t0 . . . . . 0 CA--C 1.522 -0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.3 pp -50.76 -32.22 19.13 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.983 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.76 -48.24 69.91 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.972 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 8.4 m -60.2 -38.6 83.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.085 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -47.55 78.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.15 -44.43 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.479 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.86 -51.03 68.6 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.891 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -54.82 -37.88 66.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.598 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.8 tp -60.04 -51.14 70.92 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.28 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.11 -44.22 97.68 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.3 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 . . . . . 0 C--N 1.325 -0.496 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.595 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.3 mtt . . . . . 0 N--CA 1.462 0.149 0 CA-C-O 120.798 0.332 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -59.99 -42.52 94.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.415 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.31 -33.54 73.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.654 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -70.2 -44.2 69.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.375 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -66.5 -39.46 88.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.736 179.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 72.5 m -59.7 -43.3 94.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.444 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 49.2 mtt -61.15 -45.97 92.45 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.152 -179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.33 -50.36 33.16 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.516 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 71.0 t -58.73 -43.41 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.095 -179.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.37 -45.92 90.11 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.48 82.39 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.916 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.61 -39.93 77.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.452 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.41 -41.72 90.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.61 -44.61 95.87 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.017 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.78 78.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.998 0.428 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 161' ' ' SER . 0.9 OUTLIER -60.27 -45.71 92.36 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.858 -179.244 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.55 -37.71 87.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.588 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 97.2 t -69.11 -51.72 40.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . 0.692 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -72.53 -50.54 25.01 Favored 'General case' 0 C--O 1.218 -0.578 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.184 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.502 ' N ' ' O ' ' A' ' 157' ' ' LYS . 78.2 p 24.18 35.02 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.171 0.51 . . . . 0.0 111.165 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.692 ' N ' ' O ' ' A' ' 160' ' ' ALA . 5.7 p80 -155.98 137.99 14.52 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.389 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.1 m -162.62 128.22 2.22 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.22 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -44.16 -31.38 4.08 Favored 'Trans proline' 0 N--CA 1.49 1.306 0 C-N-CA 121.85 1.7 . . . . 0.0 112.409 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 167' ' ' LEU . 1.1 m . . . . . 0 C--N 1.331 -0.198 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.482 ' N ' ' O ' ' A' ' 165' ' ' SER . 85.5 mt . . . . . 0 N--CA 1.456 -0.14 0 CA-C-O 121.101 0.477 . . . . 0.0 110.234 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.43 -42.04 79.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.046 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -60.7 -47.09 87.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.081 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 27.8 m -70.71 -40.04 76.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.657 179.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -58.53 -45.41 88.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.52 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -47.13 79.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.665 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.88 -39.9 91.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.611 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 71.2 m -60.41 -44.6 95.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.876 0.369 . . . . 0.0 110.443 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 73.0 t -63.72 -40.6 89.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.549 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 7.1 m120 . . . . . 0 C--N 1.326 -0.43 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.269 -179.707 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . 0.43 ' N ' ' CD2' ' A' ' 182' ' ' LEU . 4.1 mm? . . . . . 0 C--O 1.223 -0.32 0 CA-C-O 120.589 0.233 . . . . 0.0 110.551 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 64.0 ttm-85 -51.89 -42.29 62.59 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.726 -179.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.4 m -61.44 -52.3 65.13 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.689 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.64 -40.81 76.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.83 0.348 . . . . 0.0 110.808 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.72 -43.77 96.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.316 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.0 ttp85 -59.72 -53.04 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.613 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 21.4 m -63.22 -40.43 97.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 49.9 tp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.561 -179.356 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.464 0.245 0 CA-C-O 120.757 0.313 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -66.06 -20.76 66.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.592 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.15 -38.7 80.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.459 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.65 -46.91 86.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.815 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.13 -43.75 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 -179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.407 HD11 HG23 ' A' ' 83' ' ' ILE . 96.5 mt -62.74 -42.85 97.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -54.89 -47.32 74.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.658 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -62.02 -43.17 99.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.029 0.442 . . . . 0.0 110.516 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.7 mt -59.51 -44.25 92.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.72 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.74 -40.95 98.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.02 0.438 . . . . 0.0 110.243 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -54.65 -45.34 73.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.532 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -65.02 -41.45 95.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.603 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 94' ' ' GLY . 9.5 mt -66.43 -39.56 89.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.479 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.62 -46.46 77.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.184 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -61.68 -52.14 65.53 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.028 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.02 -25.84 36.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.7 -29.15 24.67 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.446 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.7 t70 -61.34 -45.84 92.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.785 0.326 . . . . 0.0 110.727 -179.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 90.0 p -136.45 104.91 5.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.934 0.397 . . . . 0.0 110.466 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 39.1 ttp -127.35 -16.86 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.373 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -64.9 -31.5 72.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.575 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -65.09 -40.4 94.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.186 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.943 -179.461 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.871 0.367 . . . . 0.0 110.31 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 12.2 p -59.53 -32.9 50.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.532 -179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.9 -44.72 96.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.89 -41.09 91.34 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.76 -44.31 96.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.145 0.498 . . . . 0.0 110.401 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.04 93.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.61 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.419 ' O ' ' N ' ' A' ' 115' ' ' ASN . 63.7 mt -63.28 -41.49 99.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.628 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -58.18 -47.34 83.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.455 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 64.6 tp -68.73 -43.46 75.87 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 121.544 0.688 . . . . 0.0 110.31 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.56 -37.52 86.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.216 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.419 ' N ' ' O ' ' A' ' 111' ' ' LEU . 40.0 t30 -63.9 -44.35 93.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.028 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 C--N 1.332 -0.192 0 CA-C-O 120.793 0.33 . . . . 0.0 110.416 -179.752 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.1 t0 . . . . . 0 C--O 1.232 0.151 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 65.9 mt -54.49 -31.44 55.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.714 0.292 . . . . 0.0 110.671 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.16 -47.06 75.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.421 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 23.4 m -63.68 -44.21 94.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.9 -47.74 81.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.615 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.95 -41.16 95.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.415 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -61.7 -48.88 78.77 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.98 -44.61 95.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.658 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.78 -53.32 57.57 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.306 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -38.92 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.463 -0.495 . . . . 0.0 109.857 -178.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 . . . . . 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.624 179.809 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 30.5 ttm . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.831 0.348 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.465 ' O ' ' CG2' ' A' ' 147' ' ' THR . 22.6 pt-20 -53.87 -35.32 61.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.197 0.522 . . . . 0.0 110.718 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . 0.488 ' O ' ' OG1' ' A' ' 147' ' ' THR . 47.1 tttp -64.16 -34.82 78.96 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.281 0.563 . . . . 0.0 111.147 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.78 -48.9 65.04 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.773 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -70.31 -31.69 69.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.004 0.43 . . . . 0.0 110.367 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 144' ' ' LYS . 12.2 p -60.11 -45.92 91.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.032 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mtm -62.49 -46.06 90.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.059 179.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' A' ' 149' ' ' LEU . 4.2 mm? -65.35 -47.41 76.55 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 119.591 -0.844 . . . . 0.0 110.256 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 45.7 t -60.89 -41.08 87.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.561 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.1 tp -57.79 -45.21 86.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.629 -179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.01 -41.26 95.52 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.613 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.69 -43.51 98.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.607 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.9 mt -60.78 -43.54 97.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.161 0.505 . . . . 0.0 110.031 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -44.48 96.24 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.685 -179.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.73 -35.99 75.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.495 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.14 -48.85 79.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.453 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -64.0 -40.72 97.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.916 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 76.9 t -66.32 -46.11 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.931 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -66.06 -36.06 82.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.962 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.6 p -159.17 162.92 36.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.548 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -88.87 -161.61 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 12.9 p -84.95 147.84 49.26 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.973 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -41.48 -71.79 0.05 OUTLIER 'Trans proline' 0 N--CA 1.49 1.31 0 C-N-CA 122.284 1.99 . . . . 0.0 112.456 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 4.9 t . . . . . 0 CA--C 1.532 0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.997 -179.4 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.428 ' N ' ' CD1' ' A' ' 167' ' ' LEU . 10.4 mp . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 121.066 0.46 . . . . 0.0 110.123 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -59.93 -41.99 92.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.698 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -68.25 -46.37 70.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.124 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.08 -45.94 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.473 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -60.05 -39.31 85.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.371 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.51 -49.25 78.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.348 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 23.8 m -61.07 -46.86 88.93 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.062 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.3 m -52.66 -42.42 64.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.125 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.4 -44.34 99.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.773 0.321 . . . . 0.0 110.688 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 179.469 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 56.6 mt . . . . . 0 C--O 1.223 -0.29 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -51.32 -45.78 62.36 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.965 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.1 m -62.63 -51.29 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.121 0.486 . . . . 0.0 110.008 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -62.08 -40.33 95.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.203 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 42.0 t -62.7 -44.2 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.616 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 67.2 mmt-85 -58.05 -53.62 56.23 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.148 -178.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 69.1 m -58.56 -40.92 84.42 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.497 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 84.8 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.386 -179.911 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.78 0.324 . . . . 0.0 110.428 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.49 -34.54 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.406 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -60.13 -39.51 86.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.325 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -62.12 -46.16 90.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.445 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.403 HD13 HG23 ' A' ' 82' ' ' ILE . 97.4 mt -65.69 -43.73 93.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.604 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.2 mt -60.69 -41.73 89.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -58.36 -55.05 40.03 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.803 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -52.86 -52.25 57.99 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.668 -178.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.59 -51.21 73.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.043 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -57.36 -36.86 71.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.26 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -61.87 -45.91 91.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.526 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -66.02 -43.29 88.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.931 0.396 . . . . 0.0 110.14 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.558 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.8 mp -71.42 -33.69 69.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.048 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.486 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -56.9 -48.43 78.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.439 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -72.18 -52.54 16.07 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.906 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 88.3 t -66.68 -26.33 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 121.039 0.447 . . . . 0.0 110.745 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -75.97 -37.04 39.51 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.13 -47.6 79.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.495 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.3 p -106.16 106.67 17.29 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 110.383 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.462 ' O ' ' SD ' ' A' ' 97' ' ' MET . 2.3 tmm? -171.0 -32.6 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 98' ' ' ASP . 35.5 p-10 -65.67 -22.87 66.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.956 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -60.5 -38.57 84.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.7 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.621 179.771 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.0 mt . . . . . 0 C--O 1.232 0.142 0 CA-C-O 121.007 0.432 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 3.2 m -66.44 -37.74 80.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.71 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -62.43 -41.31 98.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 0.0 110.194 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -67.89 -48.72 53.11 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.34 -41.47 98.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.142 0.496 . . . . 0.0 110.335 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.46 -48.44 74.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.337 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.73 -43.11 97.49 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.615 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -61.78 -34.93 76.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.728 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 40.0 mt -62.73 -42.68 99.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.31 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -78.12 -20.75 51.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.169 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -62.73 -34.79 77.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.307 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.2 m . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.656 -179.408 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 47.2 t0 . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.305 0.098 . . . . 0.0 110.739 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.7 mt -65.4 -34.71 78.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.729 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.42 -44.68 72.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.6 m -63.73 -46.56 84.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.401 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.19 -43.45 95.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.771 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 81.2 mt -61.64 -43.6 98.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.79 0.329 . . . . 0.0 110.22 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -68.65 -46.42 69.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.288 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -62.02 -51.49 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.748 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.5 tp -63.7 -47.9 79.29 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.855 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.33 -28.54 66.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.898 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.169 -178.195 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 36.2 ttm . . . . . 0 N--CA 1.467 0.377 0 CA-C-O 120.791 0.329 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -66.32 -35.35 80.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.566 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 20.6 tptt -60.58 -34.06 73.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.146 0.498 . . . . 0.0 110.457 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -76.56 -35.92 57.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.529 178.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -68.54 -47.13 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.555 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 73.3 m -61.92 -42.63 99.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.116 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 48.5 tpp -54.76 -46.25 74.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.97 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 94.6 mt -70.06 -46.71 64.39 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.724 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 76.3 t -60.05 -44.75 95.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.542 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.2 tt -61.46 -44.82 96.42 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.042 0.449 . . . . 0.0 110.866 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.48 89.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 43.1 tp -58.46 -40.77 83.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.187 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.46 -43.87 96.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.251 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 96.7 mt -65.48 -46.57 79.24 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.318 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.24 -40.39 90.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.095 0.474 . . . . 0.0 110.194 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . 0.493 ' O ' ' N ' ' A' ' 161' ' ' SER . 19.3 tptm -64.49 -35.33 80.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.719 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.24 -40.31 95.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.322 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 57.8 t -75.85 -50.24 23.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.865 179.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . 0.65 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -67.69 -50.1 59.38 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.814 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.493 ' N ' ' O ' ' A' ' 157' ' ' LYS . 66.8 m 25.12 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.739 0.649 . . . . 0.0 111.487 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.65 ' N ' ' O ' ' A' ' 160' ' ' ALA . 90.0 m-70 -147.88 120.58 8.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.285 -177.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.37 175.57 2.65 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.319 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -57.23 -153.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.473 2.115 . . . . 0.0 111.753 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.416 179.571 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 47.5 mt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.747 0.308 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -59.74 -44.94 93.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.577 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -64.45 -44.12 92.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.95 0.405 . . . . 0.0 110.709 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 92.9 t -64.42 -44.16 97.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.786 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -59.92 -42.18 93.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.419 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.9 -49.3 78.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.493 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.8 m -59.41 -46.19 89.4 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.058 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.6 m -52.57 -44.99 66.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.825 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 75.0 t -58.93 -41.69 83.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.078 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . 0.403 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 55.5 t-20 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 63.1 tp . . . . . 0 N--CA 1.456 -0.128 0 CA-C-O 120.628 0.251 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -60.51 -38.33 84.01 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.531 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 72.5 m -59.14 -44.95 92.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.229 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -61.84 -39.63 92.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.452 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.4 t -60.67 -48.72 87.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.513 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -63.82 -32.79 74.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.27 0.557 . . . . 0.0 110.687 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 16.3 m -57.34 -33.21 67.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.287 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.431 ' N ' ' CD2' ' A' ' 189' ' ' LEU . 4.1 mm? . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.525 179.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 p . . . . . 0 N--CA 1.468 0.428 0 CA-C-O 120.761 0.315 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -61.97 -43.24 99.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.489 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -67.33 -33.77 75.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.506 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -60.5 -37.38 80.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.603 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.419 HD11 HG22 ' A' ' 82' ' ' ILE . 93.6 mt -62.7 -44.36 99.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.38 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.6 mt -63.79 -44.7 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -55.59 -43.89 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.857 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.458 ' OD1' ' CD2' ' A' ' 89' ' ' HIS . 45.9 t-20 -63.97 -42.52 97.21 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.003 0.43 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.7 mt -60.3 -44.49 95.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.111 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.6 -50.34 73.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.963 0.411 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 94.1 mtm-85 -54.07 -45.95 71.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.458 ' CD2' ' OD1' ' A' ' 85' ' ' ASN . 36.1 m-70 -66.93 -41.82 86.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.075 0.464 . . . . 0.0 110.221 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 94' ' ' GLY . 3.2 tt -64.58 -41.7 96.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.099 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.17 82.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.396 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -65.24 -52.21 55.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.423 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.8 t -71.39 -26.4 26.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.045 0.45 . . . . 0.0 110.657 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -79.91 -40.73 13.73 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.45 -47.08 77.41 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.663 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.0 p -75.0 -31.24 61.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 54.92 -170.54 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.257 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.667 ' C ' ' H ' ' A' ' 100' ' ' SER . 51.7 t0 -86.35 2.25 48.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 60.66 -10.4 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.654 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.667 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.9 m . . . . . 0 N--CA 1.451 -0.416 0 CA-C-O 120.952 0.406 . . . . 0.0 110.08 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.3 mp . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.874 0.368 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 12.6 p -50.48 -36.32 13.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.399 -178.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -61.25 -40.07 92.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.871 0.367 . . . . 0.0 110.159 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.05 -39.89 81.08 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.468 ' CD1' ' N ' ' A' ' 109' ' ' LEU . 9.6 mp -63.58 -42.78 98.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.519 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -39.02 86.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.9 -39.8 95.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.358 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -57.98 -47.74 82.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.761 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.79 -21.83 63.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.618 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -87.73 -55.49 3.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.587 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 32.8 m . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.722 -179.584 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 63.8 t0 . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 120.595 0.236 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.6 mt -51.48 -35.76 41.37 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.98 70.15 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.225 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 99.7 m -63.29 -42.12 99.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.105 179.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.01 80.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.15 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.96 -42.37 93.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.825 0.345 . . . . 0.0 110.339 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -63.94 -49.96 70.54 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.232 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.82 -36.45 83.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.498 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.62 -55.04 39.4 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.445 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.27 -31.65 70.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.977 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 . . . . . 0 C--N 1.318 -0.78 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.112 -179.887 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 47.9 ttp . . . . . 0 N--CA 1.464 0.238 0 CA-C-O 120.755 0.312 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -65.26 -44.6 87.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -61.57 -49.58 76.08 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.784 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.44 -35.24 65.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.757 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -69.17 -49.85 52.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.209 0.528 . . . . 0.0 110.884 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 54.4 m -71.0 -41.21 71.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.762 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 53.1 ttm -52.88 -46.17 67.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 75.8 mt -63.91 -49.77 71.36 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.292 179.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.24 -45.06 99.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.99 -46.68 88.17 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.184 0.516 . . . . 0.0 110.321 -179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -59.03 -41.27 87.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.146 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 49.1 tp -59.75 -41.66 91.47 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.334 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.58 -42.86 97.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.004 0.43 . . . . 0.0 110.223 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.73 -46.53 87.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.205 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.17 -37.21 78.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . 0.594 ' HZ3' ' NH1' ' A' ' 168' ' ' ARG . 88.6 tttt -62.29 -45.03 95.08 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.563 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -63.03 -38.09 89.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.5 t -66.33 -44.79 90.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.569 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . 0.439 ' O ' ' OG ' ' A' ' 161' ' ' SER . . . -68.44 -39.78 81.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.362 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 160' ' ' ALA . 37.7 m -171.1 173.49 5.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.584 ' ND1' ' N ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER 179.25 69.08 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 84.7 m -116.87 81.7 12.37 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.42 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . 0.436 ' O ' ' CB ' ' A' ' 165' ' ' SER . 73.0 Cg_endo -82.04 -179.44 4.76 Favored 'Trans proline' 0 C--N 1.312 -1.361 0 C-N-CA 122.681 2.254 . . . . 0.0 111.872 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 179.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.531 ' CD2' ' H ' ' A' ' 167' ' ' LEU . 2.0 pt? . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 121.217 0.532 . . . . 0.0 110.317 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.594 ' NH1' ' HZ3' ' A' ' 157' ' ' LYS . 55.5 mtp85 -72.18 -40.85 67.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.893 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.03 -47.05 84.7 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.989 0.423 . . . . 0.0 111.275 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 5.8 p -65.41 -41.36 90.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.235 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -61.59 -40.9 96.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.356 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -58.21 -47.97 81.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.353 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.7 m -58.46 -42.5 87.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.896 0.379 . . . . 0.0 110.434 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 72.3 m -57.32 -42.71 82.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.081 0.467 . . . . 0.0 110.305 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.06 -40.95 84.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.359 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 120.955 0.407 . . . . 0.0 110.384 -179.882 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.225 0 CA-C-O 121.299 0.571 . . . . 0.0 110.2 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.75 -47.28 80.42 Favored 'General case' 0 C--N 1.321 -0.63 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.137 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.4 m -59.2 -43.72 92.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.089 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.2 -38.97 84.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.56 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -59.75 -49.6 83.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.082 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 91.3 mtt-85 -68.46 -52.33 33.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 74.6 m -57.84 -37.04 73.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.115 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 3.2 tt . . . . . 0 C--N 1.332 -0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.085 179.787 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.609 0.242 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -45.36 -36.39 4.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.99 -43.38 98.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.058 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.66 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.005 0.431 . . . . 0.0 110.315 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.2 mm -63.2 -43.05 98.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.521 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.61 -43.75 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.107 0.479 . . . . 0.0 110.227 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.5 ttm-85 -70.58 -55.15 9.51 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.683 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -52.99 -50.52 64.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.088 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.507 ' CG2' ' N ' ' A' ' 87' ' ' ALA . 4.0 tp -65.12 -45.74 93.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.034 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.507 ' N ' ' CG2' ' A' ' 86' ' ' ILE . . . -62.63 -36.53 83.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.444 -179.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -59.94 -48.65 80.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.572 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -66.58 -40.04 88.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.204 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.0 mt -67.52 -35.06 78.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.891 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.5 -48.27 75.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.239 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -65.87 -52.8 47.13 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.124 -0.63 . . . . 0.0 110.573 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.4 p -66.29 -26.47 38.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.628 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.93 -27.3 29.17 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -73.58 -47.38 41.01 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.798 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.0 m -71.02 -5.04 28.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.862 0.363 . . . . 0.0 110.766 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.2 ttt -62.4 -38.53 90.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -65.43 -33.33 75.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.4 ttt85 -55.58 -44.61 77.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.487 -179.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.6 m . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.167 179.687 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.9 mp . . . . . 0 N--CA 1.461 0.124 0 CA-C-O 120.736 0.303 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 7.3 p -68.44 -47.04 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.724 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -68.98 -35.73 77.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.717 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -57.84 -15.94 22.11 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.83 -47.9 78.96 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.824 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.6 -38.54 80.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.5 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.81 -39.36 94.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.824 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.89 -47.74 76.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.65 -179.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.503 ' C ' ' H ' ' A' ' 115' ' ' ASN . 4.0 mm? -68.56 -42.31 78.52 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.374 179.155 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -47.7 -14.59 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.075 0.464 . . . . 0.0 110.481 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.503 ' H ' ' C ' ' A' ' 113' ' ' LEU . 10.0 m120 -61.17 -40.72 94.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.395 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 t . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 121.13 0.491 . . . . 0.0 110.714 179.68 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 CA--C 1.521 -0.162 0 CA-C-O 120.465 0.174 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 58.0 mt -62.13 -35.76 79.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 120.639 0.256 . . . . 0.0 110.826 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -43.91 71.4 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.092 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.9 m -63.32 -47.66 81.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.239 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.58 -47.66 85.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.283 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.05 -40.44 97.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.446 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.47 -50.63 73.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.524 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -57.42 -44.7 84.87 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.702 -0.399 . . . . 0.0 109.962 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.91 -48.99 77.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.76 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.28 -42.2 86.04 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.94 -178.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 . . . . . 0 C--N 1.322 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.98 179.638 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 5.8 ptp . . . . . 0 N--CA 1.461 0.082 0 CA-C-O 120.928 0.394 . . . . 0.0 110.031 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -64.02 -49.34 72.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.443 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -65.85 -40.76 92.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.67 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.81 -35.3 76.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.417 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -72.02 -35.82 69.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.912 0.387 . . . . 0.0 110.45 178.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 77.4 m -59.74 -44.06 93.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.025 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 51.0 mtt -61.04 -45.33 95.2 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.492 -0.483 . . . . 0.0 109.737 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.72 -43.14 94.38 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.702 179.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 47.3 t -62.1 -43.25 97.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.528 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.28 -44.42 88.46 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.315 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.47 90.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.004 0.43 . . . . 0.0 110.493 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 18.9 tp -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.448 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -47.81 84.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.453 . . . . 0.0 110.253 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.0 tp -67.14 -45.27 77.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.272 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.22 87.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.618 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.0 -37.81 83.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.286 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -62.54 -43.08 99.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.125 0.488 . . . . 0.0 110.509 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.8 t -67.15 -43.83 88.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.335 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.69 -35.63 80.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.897 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 29.5 m -159.84 161.99 34.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.379 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.448 ' O ' ' OG1' ' A' ' 163' ' ' THR . 65.4 m80 -98.56 -26.19 14.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.736 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' THR . . . . . 0.448 ' OG1' ' O ' ' A' ' 162' ' ' HIS . 4.3 p 64.04 145.19 0.08 OUTLIER Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.494 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -71.67 155.66 58.5 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.466 2.111 . . . . 0.0 111.943 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' SER . . . . . 0.418 ' O ' ' N ' ' A' ' 167' ' ' LEU . 8.7 t . . . . . 0 C--N 1.328 -0.333 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.418 ' N ' ' O ' ' A' ' 165' ' ' SER . 53.7 mt . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 121.027 0.442 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -64.4 -45.83 85.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.553 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -66.12 -43.67 86.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.478 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 82.8 t -63.93 -44.94 98.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.348 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -61.0 -41.34 96.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.45 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -63.45 -49.68 72.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.815 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 16.4 m -61.74 -42.6 99.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.806 0.336 . . . . 0.0 110.432 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.7 m -53.87 -44.09 70.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.585 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.4 t -64.29 -42.12 94.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.807 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 46.3 t30 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.267 179.642 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . 0.412 ' O ' ' N ' ' A' ' 186' ' ' VAL . 55.5 mt . . . . . 0 N--CA 1.453 -0.323 0 CA-C-O 120.507 0.194 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -51.0 -42.15 60.17 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.154 -177.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 85.5 m -72.36 -51.49 20.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.793 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -63.68 -49.35 73.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.385 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . 0.412 ' N ' ' O ' ' A' ' 182' ' ' LEU . 3.0 p -58.41 -35.01 52.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.148 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 59.5 ttt85 -59.68 -52.28 66.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.903 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 78.2 p -58.73 -48.71 80.22 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.694 -179.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 10.9 mp . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.525 179.582 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.6 t . . . . . 0 N--CA 1.457 -0.111 0 CA-C-O 120.903 0.382 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -65.06 -30.49 71.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.772 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -38.84 82.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.538 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -63.05 -42.36 99.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.464 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.59 -44.78 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.415 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.4 mt -63.22 -43.66 98.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.92 0.391 . . . . 0.0 110.179 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -52.58 -54.42 33.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.825 -179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.685 HD22 ' HE2' ' A' ' 89' ' ' HIS . 14.9 t-20 -57.51 -40.94 79.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 110.672 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.4 mt -60.24 -52.87 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.277 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.54 72.69 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.117 0.484 . . . . 0.0 110.478 -179.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -61.08 -44.38 97.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.474 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.685 ' HE2' HD22 ' A' ' 85' ' ' ASN . 77.7 m-70 -66.38 -44.03 84.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.934 0.397 . . . . 0.0 110.648 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.563 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.3 mp -69.23 -35.09 75.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.572 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.52 -47.96 83.51 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.596 -179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -67.79 -52.44 37.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.344 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.4 t -66.86 -27.22 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -65.83 -39.55 95.15 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.42 -44.89 95.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.893 0.377 . . . . 0.0 110.632 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.469 ' C ' ' H ' ' A' ' 98' ' ' ASP . 68.9 m -77.32 -3.44 39.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.73 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.4 ttm -49.79 -13.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 96' ' ' SER . 88.9 m-20 -66.18 -11.25 48.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.505 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -73.51 -66.04 0.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.612 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 CA--C 1.515 -0.397 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.47 179.977 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.272 0 CA-C-O 121.179 0.514 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -70.34 -44.57 77.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.024 179.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 56.5 t-20 -57.01 -50.0 74.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.348 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -70.42 -46.56 48.01 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.427 ' O ' ' N ' ' A' ' 113' ' ' LEU . 47.2 tp -52.18 -47.75 65.37 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.929 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.32 74.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.275 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.414 ' O ' ' N ' ' A' ' 115' ' ' ASN . 82.4 mt -67.48 -46.88 71.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.005 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.459 ' O ' ' OG1' ' A' ' 116' ' ' THR . 5.6 tp-100 -64.4 -33.39 75.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.228 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 109' ' ' LEU . 53.6 tp -66.54 -39.26 88.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.945 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -91.17 -21.89 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.884 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 111' ' ' LEU . 96.7 m-20 -88.67 4.0 48.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 112' ' ' GLN . 54.0 m . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.988 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.555 0.217 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.5 mt -67.48 -43.56 80.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.804 0.335 . . . . 0.0 110.93 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.02 -32.78 74.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.436 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 21.4 m -62.33 -52.66 62.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.324 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.53 88.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.33 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.7 tp -62.0 -48.69 79.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.25 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -59.33 -35.02 73.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.239 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -63.63 -40.48 97.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.594 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.0 tp -62.13 -44.34 96.85 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.619 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.424 ' N ' ' CD1' ' A' ' 135' ' ' LEU . 9.7 mp -74.83 -32.41 61.93 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.658 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 -179.26 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 74.6 mtm . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 120.768 0.318 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.517 ' OE1' ' N ' ' A' ' 144' ' ' LYS . 7.1 tm-20 -70.71 -47.0 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' LYS . . . . . 0.517 ' N ' ' OE1' ' A' ' 143' ' ' GLU . 10.4 tptm -62.71 -48.42 79.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.841 -179.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.54 -50.78 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.355 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -63.48 -39.06 93.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.533 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' THR . . . . . 0.425 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 74.9 m -59.89 -46.86 88.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.567 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.6 mtm -64.58 -41.9 95.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.585 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 78.0 mt -63.69 -44.26 94.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.968 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 72.4 t -66.93 -43.14 89.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.432 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 55.4 tp -59.11 -46.6 87.89 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.474 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.6 -38.81 90.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.263 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.7 tp -63.68 -41.26 98.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.463 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 64.8 mt -60.22 -43.09 96.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.208 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.35 -41.84 98.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.242 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.87 -33.45 70.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.256 0.551 . . . . 0.0 110.502 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -72.46 -44.2 62.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.343 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.06 -48.2 77.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.489 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 14.9 p -62.18 -36.84 76.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.249 -179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -60.97 -51.35 69.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.625 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 23.7 p -24.14 141.47 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.793 0.683 . . . . 0.0 110.684 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' HIS . . . . . 0.57 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.5 m-70 168.51 -38.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.36 156.68 75.97 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.384 -179.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.98 144.61 88.29 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.61 2.206 . . . . 0.0 111.713 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 85.0 p . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 179.655 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 54.3 tp . . . . . 0 N--CA 1.454 -0.234 0 CA-C-O 120.793 0.33 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -65.39 -39.42 92.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.628 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -62.88 -46.63 86.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.997 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.488 ' O ' ' OG1' ' A' ' 173' ' ' THR . 77.1 t -64.3 -44.28 97.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.228 0.537 . . . . 0.0 110.17 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -57.62 -45.56 85.23 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.238 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -65.51 -41.88 92.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.86 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 18.6 p -58.82 -46.59 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.325 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.42 -43.96 88.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.029 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.9 t -59.71 -43.4 91.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.193 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 13.1 m120 . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.655 -179.586 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 182' ' ' LEU . . . . . 0.467 ' CD2' ' N ' ' A' ' 182' ' ' LEU . 4.1 mm? . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.741 0.305 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 183' ' ' ARG . . . . . 0.564 HH12 ' NH1' ' A' ' 187' ' ' ARG . 73.8 ttt-85 -53.82 -41.37 67.27 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.379 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -60.29 -51.98 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.644 -179.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -67.92 -39.57 83.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.745 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.08 -42.47 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.705 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 187' ' ' ARG . . . . . 0.564 ' NH1' HH12 ' A' ' 183' ' ' ARG . 62.3 ttp180 -60.28 -45.23 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.773 -179.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 36.2 t -58.89 -51.22 70.96 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.762 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 189' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 189' ' ' LEU . 4.0 mm? . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.674 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -89.9 -0.67 57.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.776 0.322 . . . . 0.0 110.431 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.515 ' O ' ' N ' ' A' ' 65' ' ' SER . 60.0 ttm-85 -64.04 -42.72 96.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.199 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 65' ' ' SER . 31.6 t 49.11 -87.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.674 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 63' ' ' ARG . 8.4 p 59.76 134.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.885 0.374 . . . . 0.0 110.566 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -100.62 108.91 20.93 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.417 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.2 p -136.86 3.65 2.72 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.516 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -80.78 42.51 0.63 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.741 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.99 -41.92 99.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.194 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 67.16 -174.54 26.25 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -83.03 143.19 30.78 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.523 ' O ' ' N ' ' A' ' 74' ' ' ALA . 9.9 tp -134.71 136.6 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 CA-C-O 121.001 0.429 . . . . 0.0 110.275 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -41.49 90.8 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.798 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.523 ' N ' ' O ' ' A' ' 72' ' ' ILE . . . -175.21 -31.46 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.71 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -92.37 11.92 24.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.784 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.6 t -59.03 -43.23 91.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.555 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -59.84 135.82 57.81 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.2 m 60.38 86.5 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.953 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -58.88 -30.97 68.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.341 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.82 -35.15 79.68 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.195 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -62.78 -34.42 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.2 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.47 -43.76 98.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.349 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.87 -44.12 98.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -58.06 -44.51 87.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.112 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.96 -44.49 92.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 0.0 109.98 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.2 mt -61.58 -42.31 93.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.569 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.84 -51.49 68.79 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -52.31 -44.12 64.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.327 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -60.61 -50.75 72.25 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.99 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.549 ' O ' ' N ' ' A' ' 94' ' ' GLY . 11.7 mt -57.81 -38.32 75.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.974 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.81 74.13 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -57.52 -50.95 71.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.198 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.2 t -71.42 -26.23 26.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 121.229 0.538 . . . . 0.0 110.483 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.14 -28.57 68.06 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.216 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 98' ' ' ASP . 92.6 m-20 -68.79 -37.86 79.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.746 0.308 . . . . 0.0 111.139 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.1 t -71.25 -12.76 61.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.513 -179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 89.8 mmm -71.46 -10.42 59.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.732 0.301 . . . . 0.0 110.974 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' A' ' 95' ' ' ASP . 42.1 p-10 -98.59 8.52 44.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.731 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -155.79 38.44 0.37 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.918 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 56.7 p -144.22 -24.48 0.54 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.869 0.366 . . . . 0.0 110.431 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.625 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 0.8 OUTLIER -94.96 -37.02 0.29 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.71 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.625 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 44.0 Cg_endo -85.5 163.2 10.99 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 C-N-CA 122.167 1.911 . . . . 0.0 112.81 -178.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.24 -40.07 78.71 Favored 'Trans proline' 0 N--CA 1.494 1.5 0 C-N-CA 122.099 1.866 . . . . 0.0 111.396 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.554 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . 125.21 149.57 7.56 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.511 ' CD1' ' N ' ' A' ' 105' ' ' LEU . 6.3 mp 54.93 3.45 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.729 0.3 . . . . 0.0 111.046 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.554 ' H ' ' C ' ' A' ' 104' ' ' GLY . 7.2 p -60.17 -33.74 54.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.607 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.6 t-20 -69.15 -50.14 50.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.107 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.89 -48.89 18.27 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.23 -44.15 96.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.808 0.337 . . . . 0.0 110.262 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.553 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.5 tp -66.27 -44.69 82.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.99 0.424 . . . . 0.0 110.55 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -67.62 -35.04 78.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.467 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.1 tp -60.78 -42.69 98.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.59 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -65.88 -39.29 90.54 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.746 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -62.83 -44.68 95.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.582 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 97.3 m -66.26 -46.25 77.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.023 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.499 ' O ' ' N ' ' A' ' 119' ' ' SER . 23.2 t -86.34 16.98 3.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.689 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -64.54 70.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.351 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.499 ' N ' ' O ' ' A' ' 117' ' ' SER . 54.6 p -136.83 4.9 2.82 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.539 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.408 ' O ' ' O ' ' A' ' 121' ' ' GLU . 97.6 mt-10 -141.16 -158.98 0.91 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.185 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.529 ' C ' ' H ' ' A' ' 123' ' ' ARG . 97.7 mt-10 55.58 165.86 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.189 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.0 t0 69.34 -38.49 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.697 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.529 ' H ' ' C ' ' A' ' 121' ' ' GLU . 78.3 mtp85 -63.55 -41.11 98.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.742 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.495 ' OD1' ' N ' ' A' ' 125' ' ' ARG . 13.9 p30 -87.29 -32.41 19.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.027 0.441 . . . . 0.0 110.556 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.495 ' N ' ' OD1' ' A' ' 124' ' ' ASN . 4.1 ttt180 -86.34 9.25 18.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.406 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.539 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 21.3 p-10 -64.3 -71.23 0.18 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.791 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.539 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 54.9 mt -62.61 -35.73 80.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.545 0.212 . . . . 0.0 111.009 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.82 -41.36 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.324 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.5 m -61.77 -44.47 96.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.03 0.443 . . . . 0.0 110.15 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -46.58 80.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.6 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.88 -42.81 99.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.96 -52.84 37.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -59.63 -47.88 83.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.364 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.16 -48.8 76.91 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.268 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.24 -42.62 99.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? -57.56 -41.2 80.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -107.21 72.12 0.86 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.51 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.484 ' O ' ' CD2' ' A' ' 138' ' ' TYR . 74.7 t80 -132.46 60.09 48.13 Favored Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.331 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.455 ' O ' ' O ' ' A' ' 140' ' ' ARG . 51.6 Cg_endo -71.4 -33.36 11.14 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 C-N-CA 122.59 2.193 . . . . 0.0 111.8 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.455 ' O ' ' O ' ' A' ' 139' ' ' PRO . 56.2 ttt-85 55.8 157.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.568 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.596 ' C ' ' H ' ' A' ' 143' ' ' GLU . 1.7 m-20 -62.22 -42.82 99.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.482 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 70.0 mtp 65.32 -20.1 0.09 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.031 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.596 ' H ' ' C ' ' A' ' 141' ' ' ASP . 11.1 mt-10 -65.66 -43.79 88.29 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-O 120.876 0.37 . . . . 0.0 110.485 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -63.67 -31.03 72.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.776 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -75.86 -50.67 14.42 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.221 0.534 . . . . 0.0 110.924 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -68.25 -42.07 80.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.603 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.416 ' CB ' ' O ' ' A' ' 143' ' ' GLU . 99.6 m -62.15 -42.51 99.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.389 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 42.0 ttm -59.27 -46.33 88.81 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.65 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.3 -50.31 54.45 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.945 -0.702 . . . . 0.0 110.409 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -42.92 95.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.298 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.405 ' CB ' ' O ' ' A' ' 147' ' ' THR . 48.4 tp -60.93 -43.84 98.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.307 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.76 98.22 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.156 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 51.9 tp -60.62 -41.86 95.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.8 -41.76 96.28 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.103 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 56.2 tp -62.33 -47.12 85.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.955 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.52 79.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -61.42 -45.83 92.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.384 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.86 -38.99 93.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.51 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 83.4 t -66.58 -44.46 89.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.316 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.33 -39.52 92.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.187 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 64.0 m -164.55 167.16 19.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.162 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.445 ' O ' ' C ' ' A' ' 163' ' ' THR . 33.2 m170 -112.63 115.55 28.76 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' THR . . . . . 0.445 ' C ' ' O ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER -29.39 93.55 0.05 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.442 0.464 . . . . 0.0 111.207 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 162' ' ' HIS . 32.5 Cg_exo -55.16 143.69 73.47 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 121.875 1.716 . . . . 0.0 112.291 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 11.0 p -71.41 -170.93 0.56 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.828 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 37.1 mt 67.48 -59.24 0.41 Allowed 'General case' 0 N--CA 1.462 0.174 0 O-C-N 123.56 0.538 . . . . 0.0 110.502 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 50.2 mt -64.06 -35.56 81.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.356 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -64.35 -47.09 80.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.9 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.23 -46.74 85.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.393 . . . . 0.0 110.677 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.1 -44.84 97.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.322 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.45 -43.12 97.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -57.34 -48.89 77.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.721 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 17.7 m -59.9 -47.09 87.17 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.5 m -53.48 -43.06 67.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.117 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.4 t -61.48 -40.86 87.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.326 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -59.53 -40.04 85.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.856 0.36 . . . . 0.0 110.417 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -61.45 -47.95 83.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.887 0.375 . . . . 0.0 110.491 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.403 HG23 HD13 ' A' ' 178' ' ' ILE . 96.8 mt -69.32 -36.61 73.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.706 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -49.46 -33.79 15.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.853 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -52.65 148.3 7.41 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.344 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 48.9 t30 70.97 -55.59 0.64 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.064 0.459 . . . . 0.0 110.282 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 74.5 mt -61.71 -36.0 79.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.646 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . 0.431 ' O ' ' CB ' ' A' ' 187' ' ' ARG . 39.2 mmt-85 -54.37 -31.33 54.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.539 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.6 m -58.15 -47.92 81.84 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.555 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -73.42 -48.1 36.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.003 0.43 . . . . 0.0 111.001 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 86.0 t -62.17 -44.6 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.772 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . 0.431 ' CB ' ' O ' ' A' ' 183' ' ' ARG . 77.9 ttt-85 -62.22 -44.02 97.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.482 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' SER . . . . . 0.49 ' O ' ' ND2' ' A' ' 192' ' ' ASN . 68.7 m -60.34 -40.76 91.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.886 0.374 . . . . 0.0 110.316 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 53.7 tp -64.06 -42.33 97.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . 0.432 ' O ' ' ND2' ' A' ' 192' ' ' ASN . . . -74.88 156.08 36.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.958 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 51.09 37.61 18.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.475 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.49 ' ND2' ' O ' ' A' ' 188' ' ' SER . 72.2 m-80 -154.86 153.14 30.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -79.46 -153.83 8.19 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 70.4 mmm -63.14 -40.09 96.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.654 0.264 . . . . 0.0 110.424 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.7 p-10 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.548 179.961 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -62.89 -41.64 99.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.341 . . . . 0.0 110.551 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -76.9 134.72 38.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.561 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.6 t 53.55 89.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.61 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.2 t -70.56 151.53 44.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.601 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.502 ' NE2' ' O ' ' A' ' 68' ' ' ARG . 80.8 t60 -67.95 132.49 47.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.379 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 32.0 t -141.96 46.6 1.65 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.445 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.502 ' O ' ' NE2' ' A' ' 66' ' ' HIS . 78.9 ttt-85 -156.13 87.01 1.04 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.346 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.91 144.96 43.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.313 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.16 169.58 13.3 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.434 ' O ' ' N ' ' A' ' 73' ' ' GLU . 22.6 mmt85 -64.02 -39.98 95.32 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.709 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.43 ' CG1' ' O ' ' A' ' 72' ' ' ILE . 3.9 tt 35.56 33.44 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 121.225 0.536 . . . . 0.0 111.264 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 71' ' ' ARG . 94.1 mt-10 -143.42 -59.07 0.41 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.824 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 75' ' ' ASP . . . -58.22 -23.36 55.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.46 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 77' ' ' GLU . 74.2 m-20 -58.87 -130.04 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.593 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.3 t 63.38 -67.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.719 0.295 . . . . 0.0 110.736 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 75' ' ' ASP . 45.1 mt-10 -59.84 -43.12 94.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.383 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.3 p -64.01 -33.48 75.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.723 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 68.22 -60.16 0.42 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.612 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -61.24 -33.75 74.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.378 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.433 ' OD2' ' OD1' ' A' ' 75' ' ' ASP . 32.8 t0 -58.4 -28.56 65.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.205 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.7 mt -60.91 -47.33 93.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.231 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.409 HG21 HD13 ' A' ' 83' ' ' ILE . 94.3 mt -62.35 -45.1 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -55.82 -44.47 77.92 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.975 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -63.7 -45.09 91.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.017 0.437 . . . . 0.0 110.41 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.424 HD13 HG21 ' A' ' 86' ' ' ILE . 76.6 mt -58.17 -44.58 87.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.105 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.75 93.85 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.425 -0.51 . . . . 0.0 109.813 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -52.6 -45.56 66.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.047 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -46.59 89.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.155 0.502 . . . . 0.0 110.307 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.493 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.0 mp -62.22 -39.57 93.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.074 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.08 -41.32 78.6 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.017 0.437 . . . . 0.0 110.229 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -63.19 -51.9 64.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.111 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.91 -26.36 30.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.245 0.545 . . . . 0.0 110.342 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -73.64 -41.63 42.66 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -63.95 -42.97 97.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.775 0.322 . . . . 0.0 110.632 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 51.1 m -57.09 -39.48 75.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.427 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.04 60.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.293 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.458 ' OD1' ' CD ' ' A' ' 103' ' ' PRO . 67.6 t0 -169.72 42.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.418 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -131.84 -38.38 1.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t -101.59 0.58 36.61 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.857 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.414 ' O ' ' CG2' ' A' ' 101' ' ' ILE . 19.7 tt -138.34 62.04 28.76 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.018 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -36.72 98.53 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.332 0 C-N-CA 122.509 2.139 . . . . 0.0 111.632 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.458 ' CD ' ' OD1' ' A' ' 98' ' ' ASP . 69.4 Cg_endo -83.67 -82.22 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.369 2.046 . . . . 0.0 112.513 -179.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.486 ' O ' ' N ' ' A' ' 108' ' ' GLY . . . -45.2 -36.31 5.37 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.59 -64.56 0.91 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.075 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 85.6 t -64.32 -46.15 93.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.974 0.416 . . . . 0.0 110.732 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -63.38 -50.34 70.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.883 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 104' ' ' GLY . . . -60.71 -32.95 80.62 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.2 tp -61.54 -46.41 90.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -54.96 -48.93 72.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.117 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 11.2 mp -65.84 -39.2 90.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.488 178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.34 -45.26 91.86 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.124 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.4 tp -63.65 -42.59 98.09 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.699 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.651 HH12 ' NH2' ' A' ' 118' ' ' ARG . 59.2 ttm-85 -75.2 -42.89 54.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.009 0.433 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -44.92 -17.55 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.171 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.479 ' N ' ' O ' ' A' ' 114' ' ' ARG . 16.4 m -59.23 -47.7 84.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 119' ' ' SER . 18.7 m -163.64 -137.56 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.052 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.651 ' NH2' HH12 ' A' ' 114' ' ' ARG . 72.2 mtp180 57.17 -78.93 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.605 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.545 ' HG ' ' H ' ' A' ' 120' ' ' GLU . 29.7 t -82.83 -172.48 4.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.376 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.545 ' H ' ' HG ' ' A' ' 119' ' ' SER . 93.8 mt-10 59.44 9.06 1.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.504 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.467 ' C ' ' N ' ' A' ' 123' ' ' ARG . 75.9 mm-40 -105.67 179.93 4.12 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.71 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 50.2 p-10 -47.03 -16.49 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.459 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.467 ' N ' ' C ' ' A' ' 121' ' ' GLU . 62.1 ttm-85 -61.24 -44.52 97.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.559 ' O ' ' N ' ' A' ' 126' ' ' ASP . 61.6 t-20 -120.41 -73.24 0.65 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.814 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -51.84 85.23 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.165 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.559 ' N ' ' O ' ' A' ' 124' ' ' ASN . 66.6 t0 -173.43 -102.15 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.525 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.1 mt -50.32 -38.19 40.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.451 -178.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.81 -48.95 69.36 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.26 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.3 m -60.94 -42.78 98.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.574 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.52 -47.94 78.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.346 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.91 -41.59 87.62 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.459 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -55.44 -51.41 67.01 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.941 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -53.99 -47.73 71.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.678 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.21 -43.53 94.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.442 . . . . 0.0 109.966 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.4 -46.88 79.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.498 -178.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -55.77 -25.43 40.88 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.569 -0.452 . . . . 0.0 109.96 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.67 74.8 1.4 Allowed 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.775 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.662 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 12.3 t80 -90.28 -32.75 0.37 Allowed Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.775 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.662 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 51.3 Cg_exo -52.7 81.69 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.856 1.704 . . . . 0.0 112.359 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' A' ' 138' ' ' TYR . 13.7 ptm180 -155.59 159.25 39.5 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.765 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 54.91 34.6 22.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.63 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.6 ttp -160.46 -71.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.624 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -65.33 -35.12 80.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 26.9 tptt -61.53 -47.64 84.66 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.837 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -64.01 -41.75 97.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.825 0.345 . . . . 0.0 110.569 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -58.29 -42.24 86.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.45 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.1 m -60.19 -46.84 88.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.709 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.2 mtm -64.59 -41.53 96.19 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.749 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 7.7 mp -63.99 -41.1 97.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.727 0.299 . . . . 0.0 110.626 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 53.8 t -60.83 -45.06 98.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.476 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.2 tp -61.39 -45.41 94.49 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.463 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.94 -37.0 86.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.639 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.87 -41.92 99.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.417 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.02 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.18 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 91.4 mt -61.39 -43.31 99.08 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.023 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -71.65 -46.62 58.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.47 179.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.97 -37.46 87.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.507 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -61.07 -44.55 97.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.596 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.17 -48.81 86.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.323 -179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.14 -38.54 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.952 0.406 . . . . 0.0 110.955 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.564 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 29.4 t -72.04 -165.57 0.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.416 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.564 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.9 m-70 167.38 89.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.119 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.1 p -123.74 152.98 66.64 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.584 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -68.03 156.36 66.14 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.489 2.126 . . . . 0.0 111.7 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 83.8 p -94.24 -6.5 44.45 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.624 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 56.7 mt -63.77 -50.33 69.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.794 0.33 . . . . 0.0 111.07 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.494 ' N ' ' CD2' ' A' ' 167' ' ' LEU . 3.9 mm? -67.92 -38.37 82.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.519 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -61.87 -38.02 86.72 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.42 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -62.72 -46.89 85.99 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.557 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.0 t -66.63 -48.92 78.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.049 0.452 . . . . 0.0 110.143 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -56.23 -39.46 72.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.628 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -61.56 -41.37 97.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.687 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 99.3 m -59.54 -46.59 88.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.551 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 81.7 m -57.88 -43.71 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.029 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.9 t -56.67 -43.79 79.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.721 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.4 -38.23 88.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.771 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -56.62 -46.05 81.17 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.758 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 2.1 mp -62.38 -38.36 81.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -60.35 -33.71 72.81 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.882 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . 0.421 ' O ' ' N ' ' A' ' 182' ' ' LEU . 50.9 tt0 -83.92 118.13 23.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.431 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 7.3 m120 62.16 -57.95 0.13 Allowed 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . 0.421 ' N ' ' O ' ' A' ' 180' ' ' GLN . 11.1 mp -48.43 -35.84 13.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.169 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 187' ' ' ARG . 61.0 ttt85 -51.51 -43.28 62.2 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.498 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -63.44 -52.3 62.04 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.749 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -68.5 -41.0 80.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.833 0.349 . . . . 0.0 111.282 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 189' ' ' LEU . 40.7 t -62.76 -45.77 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.552 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 183' ' ' ARG . 64.5 ttm-85 -60.56 -52.54 64.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.42 -178.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 79.8 p -63.72 -38.95 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.726 0.298 . . . . 0.0 110.616 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.466 ' O ' ' O ' ' A' ' 190' ' ' ALA . 54.7 tp -82.78 124.94 30.74 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.308 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . 0.466 ' O ' ' O ' ' A' ' 189' ' ' LEU . . . 54.61 112.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.564 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -62.82 135.0 57.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.43 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -97.84 11.1 38.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.308 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -59.72 156.17 28.16 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 50.9 ttp -84.6 128.9 34.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.799 0.333 . . . . 0.0 110.543 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.6 t0 . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.836 179.799 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.459 ' H2 ' ' H ' ' A' ' 62' ' ' ASN . . . . . . . . 0 N--CA 1.491 2.352 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.459 ' H ' ' H2 ' ' A' ' 61' ' ' GLY . 32.7 p-10 -81.39 -6.85 59.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.767 0.318 . . . . 0.0 110.628 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -149.86 161.07 43.0 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.562 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 62.3 p -151.37 110.04 3.83 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.453 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 52.5 m -61.7 -42.49 99.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.562 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -143.42 146.73 33.7 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.497 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.1 p -102.25 76.11 1.55 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.497 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -92.73 6.12 48.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.692 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.451 ' CD1' ' N ' ' A' ' 69' ' ' LEU . 9.6 mp -77.71 133.01 38.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.192 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -154.38 -50.07 0.01 OUTLIER Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.439 ' O ' ' O ' ' A' ' 72' ' ' ILE . 84.0 mtp180 -91.65 -2.24 57.14 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.88 0.371 . . . . 0.0 110.493 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.465 ' CG2' ' N ' ' A' ' 73' ' ' GLU . 82.8 mt 54.34 166.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.364 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.465 ' N ' ' CG2' ' A' ' 72' ' ' ILE . 0.1 OUTLIER 79.77 -34.18 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.281 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.425 ' H ' ' C ' ' A' ' 72' ' ' ILE . . . -82.25 2.41 32.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.453 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.401 ' O ' ' OG ' ' A' ' 78' ' ' SER . 44.6 p-10 -79.86 22.41 0.49 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.567 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 74' ' ' ALA . 92.5 p -55.65 -26.12 42.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.284 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -65.69 -22.95 66.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.284 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.401 ' OG ' ' O ' ' A' ' 75' ' ' ASP . 89.0 p -63.54 -19.99 65.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.481 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.38 -9.47 56.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.18 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -71.34 -37.0 71.74 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.434 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.35 -51.48 69.32 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.281 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 12.9 tt -65.18 -41.3 91.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.094 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.6 mt -63.09 -42.35 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.171 178.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -55.72 -48.77 74.6 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.623 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -60.84 -41.79 96.53 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.515 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.01 -44.63 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.897 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.85 -46.28 78.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.803 0.335 . . . . 0.0 110.35 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 95.2 mtm-85 -56.25 -43.52 78.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.649 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -64.12 -45.54 88.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.085 0.469 . . . . 0.0 110.475 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.05 -35.69 80.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.204 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.51 82.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.712 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.95 -52.52 55.84 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.529 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.73 -25.93 31.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.758 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.546 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -84.44 -35.34 14.42 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.318 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -65.15 -47.15 78.07 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.537 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 29.8 t -166.0 152.63 9.54 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.725 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.7 tpt -154.93 128.72 8.67 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.144 0.497 . . . . 0.0 110.602 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.563 ' O ' ' N ' ' A' ' 100' ' ' SER . 89.7 m-20 40.09 65.04 0.79 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.226 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.501 ' C ' ' H ' ' A' ' 101' ' ' ILE . 90.1 mtm180 -38.02 -24.07 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.188 0.518 . . . . 0.0 110.598 -179.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 98' ' ' ASP . 26.8 t -73.08 17.86 0.12 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.628 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.501 ' H ' ' C ' ' A' ' 99' ' ' ARG . 18.8 tt -131.64 53.9 12.84 Favored Pre-proline 0 N--CA 1.468 0.459 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.281 -179.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 85.4 Cg_exo -32.16 94.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.78 2.32 . . . . 0.0 112.159 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -84.29 -86.92 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.153 1.902 . . . . 0.0 111.874 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.541 ' O ' ' N ' ' A' ' 108' ' ' GLY . . . -65.24 -23.48 69.93 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.094 -0.802 . . . . 0.0 111.094 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.443 ' N ' ' CD2' ' A' ' 105' ' ' LEU . 4.0 mm? -59.68 -71.03 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.63 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.43 ' CG1' ' N ' ' A' ' 107' ' ' ASN . 12.7 p -61.17 -43.77 97.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.643 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.431 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 50.2 t-20 -65.84 -36.4 83.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.0 110.489 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 104' ' ' GLY . . . -47.99 -26.04 4.18 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.466 ' N ' ' CD2' ' A' ' 109' ' ' LEU . 4.0 mm? -62.66 -43.48 98.69 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.022 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.06 -40.09 69.95 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.893 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 50.6 tp -66.69 -41.47 88.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.708 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -54.68 -42.78 71.83 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.31 -40.44 97.34 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.435 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.449 ' O ' ' OG ' ' A' ' 117' ' ' SER . 99.7 mtt180 -74.06 -28.12 61.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.421 . . . . 0.0 110.596 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.538 ' O ' ' NE ' ' A' ' 118' ' ' ARG . 93.7 m-20 -63.57 -41.88 98.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 t -73.38 -33.7 65.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.696 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.603 ' C ' ' H ' ' A' ' 119' ' ' SER . 92.6 p -54.69 -82.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.738 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.538 ' NE ' ' O ' ' A' ' 115' ' ' ASN . 82.1 mtt-85 65.51 -34.24 0.18 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.017 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.603 ' H ' ' C ' ' A' ' 117' ' ' SER . 32.4 t -63.21 -42.92 99.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.008 0.433 . . . . 0.0 110.847 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -64.42 -41.46 96.59 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.526 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -87.44 -172.45 3.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.116 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.656 ' H ' ' HE ' ' A' ' 125' ' ' ARG . 98.3 m-20 57.99 40.22 25.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.738 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -126.46 -57.17 1.38 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.623 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -85.11 -41.71 15.45 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.939 0.4 . . . . 0.0 110.921 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.656 ' HE ' ' H ' ' A' ' 122' ' ' ASP . 26.6 ptt180 -74.27 -7.41 52.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.297 -179.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.549 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 25.6 p-10 -48.23 -71.04 0.07 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.331 -179.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.549 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 51.9 mt -67.1 -34.24 77.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 110.812 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -39.39 66.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.1 m -62.03 -47.35 85.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.433 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.72 -43.59 94.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.946 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.28 -41.7 98.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 110.476 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -60.31 -46.58 89.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.358 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.46 -52.65 63.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.65 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.24 -49.49 73.94 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.157 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 56.7 tp -57.19 -38.08 73.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.274 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -57.15 -27.48 61.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.261 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -135.27 60.24 1.7 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.001 0.429 . . . . 0.0 110.906 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.646 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 17.0 t80 -90.1 -32.27 0.37 Allowed Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.768 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.646 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 51.1 Cg_exo -53.0 85.76 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.891 1.727 . . . . 0.0 112.235 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 138' ' ' TYR . 14.3 ptm180 -148.32 153.02 38.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.803 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 49.55 51.99 15.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.459 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 38.8 ttm -105.48 -32.69 8.41 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.452 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.411 ' O ' ' OG1' ' A' ' 147' ' ' THR . 43.5 tp10 -67.16 -35.07 78.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.73 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.58 -31.58 69.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.725 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -69.05 -47.95 64.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.148 0.499 . . . . 0.0 110.815 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -67.24 -38.13 84.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.721 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 10.2 m -58.55 -43.27 89.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.113 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.5 mtt -61.41 -46.4 90.29 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.04 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.6 mp -65.71 -45.85 81.21 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 119.622 -0.831 . . . . 0.0 110.466 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 64.9 t -60.53 -42.54 91.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 27.1 mt -60.01 -42.59 94.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.036 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.73 -43.74 95.62 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.174 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.489 ' CD1' ' HZ1' ' A' ' 157' ' ' LYS . 38.0 tp -60.72 -42.31 97.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.0 mt -61.25 -43.43 98.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.049 0.452 . . . . 0.0 110.158 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.41 -44.09 95.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.054 179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.23 -35.46 76.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.489 ' HZ1' ' CD1' ' A' ' 153' ' ' LEU . 26.8 mmtm -60.27 -48.99 79.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.044 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -67.31 -40.75 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.022 0.439 . . . . 0.0 110.897 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 71.1 t -67.71 -44.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.535 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.75 96.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.573 ' HG ' ' H ' ' A' ' 162' ' ' HIS . 25.8 t -173.51 179.2 2.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.351 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.573 ' H ' ' HG ' ' A' ' 161' ' ' SER . 82.3 m-70 -128.42 143.94 51.07 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.063 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.4 p -78.36 150.05 76.37 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.607 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.48 156.34 61.67 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.26 1.974 . . . . 0.0 112.012 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' SER . . . . . 0.401 ' O ' ' CB ' ' A' ' 166' ' ' LEU . 72.3 m -85.45 179.93 7.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.381 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . 0.401 ' CB ' ' O ' ' A' ' 165' ' ' SER . 0.2 OUTLIER 76.73 -59.41 0.49 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.654 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.474 ' CD1' ' N ' ' A' ' 167' ' ' LEU . 9.0 mp -62.64 -26.02 68.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.088 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.45 -42.64 99.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.14 -45.79 86.96 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.996 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.69 -44.53 96.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.467 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.88 -41.9 92.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.284 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.96 -48.71 80.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.612 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.8 m -59.3 -46.73 87.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.078 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.6 m -52.94 -43.11 66.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.986 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.4 t -61.04 -44.98 99.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.366 179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -72.13 -30.76 65.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.024 0.44 . . . . 0.0 110.464 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -58.15 -41.04 82.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.58 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.8 mt -60.31 -42.52 90.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.599 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -49.81 -34.53 19.88 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.787 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -49.37 -88.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.468 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -88.4 58.1 4.55 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.304 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp -61.72 -40.29 94.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.715 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.47 -45.65 93.37 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 18.9 m -58.0 -46.64 84.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.855 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -54.19 -41.97 69.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.61 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 70.9 t -60.3 -50.83 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.284 -0.567 . . . . 0.0 110.246 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -67.85 -33.83 75.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.274 0.559 . . . . 0.0 110.475 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 35.2 t -58.04 -44.08 87.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.172 -179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.597 ' O ' ' N ' ' A' ' 191' ' ' ARG . 1.0 OUTLIER -172.75 135.27 0.64 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.365 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -54.91 78.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . 0.597 ' N ' ' O ' ' A' ' 189' ' ' LEU . 79.7 ttt-85 -92.31 -97.91 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.285 -179.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 12.7 m120 53.53 35.48 20.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.788 0.328 . . . . 0.0 110.618 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . 0.434 ' O ' ' O ' ' A' ' 194' ' ' MET . . . 177.24 -168.54 40.35 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' MET . . . . . 0.501 ' O ' ' NH2' ' A' ' 191' ' ' ARG . 0.0 OUTLIER 53.96 109.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.928 0.394 . . . . 0.0 110.683 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.7 t0 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.416 179.891 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -81.69 131.82 35.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.862 0.363 . . . . 0.0 110.437 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -141.34 124.74 16.61 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.329 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.2 t -68.81 137.72 54.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.478 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.526 ' O ' ' CG ' ' A' ' 66' ' ' HIS . 34.9 t -62.01 -44.15 97.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.434 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.526 ' CG ' ' O ' ' A' ' 65' ' ' SER . 91.4 m-70 -157.86 162.1 38.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.591 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.6 t -65.69 139.81 58.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.496 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.559 ' O ' ' N ' ' A' ' 70' ' ' GLY . 83.2 mtp180 -61.2 -45.14 95.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.889 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 78.7 mt 57.04 -74.18 0.02 OUTLIER 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.704 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.559 ' N ' ' O ' ' A' ' 68' ' ' ARG . . . 107.17 20.98 8.3 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 44.08 34.82 1.03 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 110.723 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 28.4 pt -66.69 -22.61 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.502 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -78.1 -174.26 3.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.524 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 70.5 -56.15 0.61 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.546 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -81.4 23.25 0.63 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.623 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.0 p -55.89 -36.58 67.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.548 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.0 tm-20 -122.17 112.95 18.82 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.223 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 80' ' ' GLU . 60.5 m 46.67 -106.01 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.343 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 68.0 -38.43 0.36 Allowed 'General case' 0 CA--C 1.528 0.115 0 O-C-N 123.495 0.497 . . . . 0.0 110.738 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.557 ' H ' ' C ' ' A' ' 78' ' ' SER . 16.5 mm-40 -64.81 -33.74 76.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.276 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -58.22 -30.79 66.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.342 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.13 -45.95 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.874 0.369 . . . . 0.0 110.187 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.406 HD13 HG23 ' A' ' 83' ' ' ILE . 93.5 mt -65.12 -42.1 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.507 179.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -56.49 -44.57 80.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.478 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -64.67 -41.53 96.02 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 110.528 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 80.4 mt -60.14 -41.73 87.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.208 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.141 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 75.8 mtp85 -54.63 -45.74 73.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.431 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -63.69 -49.93 71.2 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.387 0.613 . . . . 0.0 110.232 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.1 -32.56 73.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.903 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -65.58 -36.33 83.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.264 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -63.56 -52.04 62.79 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.229 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.02 -26.37 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.415 0.626 . . . . 0.0 110.715 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.21 -38.56 10.95 Favored Glycine 0 N--CA 1.466 0.644 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.66 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.6 t70 -78.75 -44.07 24.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.415 0.15 . . . . 0.0 111.045 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 5.0 m -77.02 121.47 23.56 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.086 0.469 . . . . 0.0 110.809 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 94.0 mmm -140.38 19.45 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -63.23 -38.92 93.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.725 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -61.51 -40.41 94.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.651 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.9 m -82.34 -73.48 0.39 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 4.3 pt -102.46 147.21 33.67 Favored Pre-proline 0 N--CA 1.464 0.271 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.77 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.21 150.42 76.75 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 C-N-CA 122.152 1.901 . . . . 0.0 112.094 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -71.83 153.13 58.77 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.751 2.301 . . . . 0.0 112.003 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.534 ' O ' ' N ' ' A' ' 106' ' ' VAL . . . 39.13 -137.38 1.09 Allowed Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.8 mp 56.94 -77.96 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.745 0.307 . . . . 0.0 110.728 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.534 ' N ' ' O ' ' A' ' 104' ' ' GLY . 9.9 p -55.51 -43.34 72.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.98 0.419 . . . . 0.0 110.525 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.477 ' N ' ' CG1' ' A' ' 106' ' ' VAL . 65.8 t30 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.633 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -60.34 -34.81 86.48 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 17.2 mt -61.55 -42.3 98.63 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.481 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.51 -39.16 70.14 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.371 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.2 mt -67.78 -38.19 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.848 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -59.12 -40.6 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.151 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.13 -42.56 99.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.923 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 67.7 ttt-85 -78.43 -42.1 31.04 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.038 0.447 . . . . 0.0 110.677 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.598 ' C ' ' H ' ' A' ' 117' ' ' SER . 97.8 m-20 -48.78 -31.78 7.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.833 -178.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.4 t -59.78 3.71 0.05 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.585 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.598 ' H ' ' C ' ' A' ' 115' ' ' ASN . 9.4 p 54.76 46.04 25.42 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.95 0.405 . . . . 0.0 110.448 -178.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.429 ' CG ' ' N ' ' A' ' 119' ' ' SER . 13.8 ptm180 -58.55 -46.18 87.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.645 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.429 ' N ' ' CG ' ' A' ' 118' ' ' ARG . 67.0 m -166.98 153.73 8.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.566 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -83.86 72.61 10.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.202 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -58.52 -17.39 20.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -87.8 10.69 17.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.432 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.54 -43.96 96.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.494 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.555 ' C ' ' H ' ' A' ' 126' ' ' ASP . 15.6 m120 -65.82 -39.47 90.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.236 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.533 ' NH1' ' OE2' ' A' ' 132' ' ' GLU . 0.0 OUTLIER -71.27 17.44 0.08 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.373 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.555 ' H ' ' C ' ' A' ' 124' ' ' ASN . 42.8 t0 -74.69 -78.58 0.1 Allowed 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.733 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 51.5 mt -66.75 -34.99 79.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.835 0.35 . . . . 0.0 111.019 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -36.12 63.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.797 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.435 ' OG1' ' O ' ' A' ' 125' ' ' ARG . 72.4 m -61.23 -46.76 89.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.446 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.53 89.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.581 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.37 -42.88 99.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.638 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.533 ' OE2' ' NH1' ' A' ' 125' ' ' ARG . 93.3 mt-10 -62.61 -48.94 77.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.668 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -58.86 -43.14 90.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.425 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 46.2 tp -63.57 -46.92 83.68 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.325 -0.55 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.43 -37.75 76.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.294 0.569 . . . . 0.0 110.59 -178.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -55.84 -25.45 42.05 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.416 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -162.01 93.14 0.87 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.655 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.636 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 5.0 p90 -131.49 75.7 76.53 Favored Pre-proline 0 N--CA 1.47 0.574 0 CA-C-O 121.777 0.799 . . . . 0.0 110.654 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -79.92 47.3 2.48 Favored 'Trans proline' 0 C--N 1.299 -2.032 0 C-N-CA 122.242 1.961 . . . . 0.0 111.647 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 142' ' ' MET . 76.9 ttt180 -68.06 129.84 41.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.682 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' A' ' 143' ' ' GLU . 99.4 m-20 39.25 -97.0 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.737 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' MET . . . . . 0.417 ' N ' ' O ' ' A' ' 140' ' ' ARG . 38.1 ttm 60.8 -73.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.481 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 141' ' ' ASP . 82.9 tt0 -68.38 -33.9 75.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -61.74 -34.83 76.52 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -69.87 -38.91 76.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.575 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -68.32 -39.98 81.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.964 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 85.4 m -60.12 -43.01 95.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.312 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.1 tpp -60.27 -46.82 88.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.227 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.02 -46.5 71.05 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.5 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 67.9 t -62.26 -41.89 93.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.402 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 47.9 tp -58.28 -45.79 87.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.12 -39.78 93.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.976 0.417 . . . . 0.0 110.266 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 44.3 tp -60.39 -41.22 93.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.83 -44.43 96.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.116 0.484 . . . . 0.0 110.068 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.01 -45.4 92.52 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.213 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.07 -35.81 78.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.549 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -60.31 -47.45 85.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.489 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.23 -39.23 94.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.065 0.46 . . . . 0.0 110.428 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 78.0 t -68.35 -43.17 84.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.557 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.25 99.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.333 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 46.3 t -156.24 154.74 31.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 110.548 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -81.96 -35.8 28.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.611 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 m 64.95 84.38 0.18 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.224 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.97 147.61 62.4 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 122.725 2.283 . . . . 0.0 112.232 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 31.1 t -64.86 113.63 3.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.469 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 55.6 tp -174.09 -80.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.327 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 61.3 mt -62.69 -25.6 68.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.516 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -60.84 -43.93 97.64 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.372 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -70.01 -43.88 70.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.036 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.05 -46.73 95.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.603 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -65.01 -37.06 86.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.727 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -59.69 -49.42 77.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.302 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.3 m -59.58 -46.13 89.85 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.863 0.363 . . . . 0.0 110.371 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.0 m -53.22 -43.8 67.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.44 -43.17 97.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.772 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -66.34 -38.65 88.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.944 0.402 . . . . 0.0 110.842 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -60.09 -39.92 87.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.561 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.2 mt -61.93 -42.27 94.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.6 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . 0.478 ' O ' ' O ' ' A' ' 180' ' ' GLN . 98.5 m-20 -52.05 -34.33 42.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.222 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . 0.478 ' O ' ' O ' ' A' ' 179' ' ' ASN . 87.1 mt-30 -38.73 -100.57 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.194 0.521 . . . . 0.0 111.103 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -130.32 -8.01 4.24 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.142 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 10.9 mp -59.8 -36.09 76.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.448 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . 0.407 ' HE ' ' HA ' ' A' ' 179' ' ' ASN . 5.9 ptp180 -50.74 -45.03 58.59 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.128 -177.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.6 m -62.32 -50.41 71.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.14 0.495 . . . . 0.0 110.456 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -65.35 -36.94 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.729 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 40.4 t -61.46 -46.29 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.493 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -60.61 -53.61 55.39 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.146 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 47.9 m -58.71 -40.19 82.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.872 0.368 . . . . 0.0 110.432 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 25.4 mt -62.79 -42.16 99.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.59 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . 0.46 ' O ' ' O ' ' A' ' 191' ' ' ARG . . . -168.57 156.81 8.28 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.065 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . 0.46 ' O ' ' O ' ' A' ' 190' ' ' ALA . 95.7 mtt-85 57.59 131.78 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 O-C-N 123.503 0.502 . . . . 0.0 110.766 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.414 ' OD1' ' O ' ' A' ' 192' ' ' ASN . 44.8 p30 -160.94 140.45 10.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.433 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . 72.88 27.86 68.06 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 75.2 mtm -63.59 -40.56 97.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.804 0.335 . . . . 0.0 110.476 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.4 t0 . . . . . 0 C--O 1.22 -0.447 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.638 179.996 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -62.84 -41.5 99.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.774 0.321 . . . . 0.0 110.531 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.69 ' HE ' ' NE ' ' A' ' 99' ' ' ARG . 84.1 mtp180 -76.33 142.05 41.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.443 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.9 m 54.01 87.89 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.478 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -132.73 41.24 3.19 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.465 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 44.28 -167.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.718 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.4 p -71.75 162.66 29.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.25 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 17.9 mmm180 -108.45 94.13 4.89 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.297 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.5 mt -113.54 134.15 54.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.178 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -168.45 -35.94 0.02 OUTLIER Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -89.85 37.95 0.9 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.882 0.373 . . . . 0.0 110.817 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 68.2 mt -65.76 -43.24 93.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.396 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 73' ' ' GLU . 58.1 mp0 -66.61 -35.98 81.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.513 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -85.86 60.14 6.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.504 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 50.7 p-10 -142.37 14.59 2.01 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.421 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 77.7 p -61.58 -42.25 98.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.632 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -65.38 -41.83 93.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.437 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.0 t -151.75 143.86 23.91 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.141 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -120.82 -46.94 2.32 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.545 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.63 -41.59 88.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.748 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.37 -39.36 94.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.0 mm -61.36 -44.16 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.232 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.0 mt -61.9 -41.74 91.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.179 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -59.88 -40.39 88.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.76 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -66.65 -52.46 44.75 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.807 0.337 . . . . 0.0 110.943 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.9 -38.31 72.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.017 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.99 -51.75 68.71 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.226 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -54.32 -48.95 70.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.44 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -66.94 -45.16 78.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.398 0.618 . . . . 0.0 110.245 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.538 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.3 tt -59.65 -40.66 88.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.273 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.89 -46.92 86.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.382 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.03 -52.18 65.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.27 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.5 t -74.51 -25.99 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.429 0.633 . . . . 0.0 110.719 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.538 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.33 -24.1 76.88 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.862 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.496 ' O ' ' CB ' ' A' ' 96' ' ' SER . 99.6 m-20 -72.58 -46.82 52.45 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.921 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.496 ' CB ' ' O ' ' A' ' 95' ' ' ASP . 1.8 m 158.23 -79.54 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.64 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.438 ' O ' ' O ' ' A' ' 96' ' ' SER . 24.7 mmm 57.87 121.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.453 -179.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 53.21 21.47 2.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.545 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.69 ' NE ' ' HE ' ' A' ' 63' ' ' ARG . 83.8 mtp180 -138.83 -32.49 0.68 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.481 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 7.3 t -163.39 80.55 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.955 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.501 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 14.1 pt -155.12 49.98 0.48 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.412 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 82.1 Cg_exo -35.41 99.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 123.026 2.484 . . . . 0.0 111.835 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.45 ' O ' ' O ' ' A' ' 104' ' ' GLY . 52.4 Cg_exo -53.23 135.06 59.01 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.291 1.994 . . . . 0.0 112.326 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.507 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . 44.28 -169.47 0.02 OUTLIER Glycine 0 C--N 1.335 0.49 0 N-CA-C 109.917 -1.273 . . . . 0.0 109.917 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.447 ' CD1' ' N ' ' A' ' 105' ' ' LEU . 9.1 mp 64.08 -45.98 0.28 Allowed 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.866 0.392 . . . . 0.0 110.708 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.507 ' H ' ' C ' ' A' ' 104' ' ' GLY . 9.1 p -54.86 -39.01 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.188 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.531 ' OD1' ' N ' ' A' ' 108' ' ' GLY . 45.0 p-10 -58.63 -29.73 66.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.341 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.531 ' N ' ' OD1' ' A' ' 107' ' ' ASN . . . -69.71 -50.38 30.9 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.489 ' CD1' ' N ' ' A' ' 109' ' ' LEU . 8.7 mp -63.0 -42.38 99.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.929 0.395 . . . . 0.0 110.434 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.94 -49.04 76.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.629 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 72.2 mt -71.01 -44.04 66.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.919 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.3 tm0? -57.63 -41.2 80.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.12 -43.9 97.82 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 119.809 -0.756 . . . . 0.0 110.142 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.456 ' O ' ' OG ' ' A' ' 117' ' ' SER . 84.2 mtt85 -71.87 -28.71 63.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.047 0.451 . . . . 0.0 110.268 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -62.87 -38.09 89.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.738 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.9 t -89.61 10.28 23.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.456 ' OG ' ' O ' ' A' ' 114' ' ' ARG . 70.3 p -91.76 -5.61 53.28 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.66 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 83.4 mtt85 -68.0 -19.8 64.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.612 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.6 m -73.34 -6.55 46.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.638 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -169.25 126.83 0.95 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.591 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -174.86 -52.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.579 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -67.3 -19.53 65.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.527 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -57.14 -111.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.75 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -67.68 69.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.687 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 59.0 ttm-85 -157.46 -29.56 0.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.394 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -48.92 -82.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.321 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.2 mt -51.24 -33.43 28.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -49.36 69.73 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.435 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.4 m -61.69 -43.15 99.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.99 78.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.429 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -59.49 -41.64 90.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.56 -50.19 72.31 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.163 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -55.33 -45.54 76.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.449 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.56 -47.82 82.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.019 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.39 -41.23 79.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.7 -177.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -56.03 -25.41 44.48 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.126 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -124.68 77.36 1.59 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.787 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.68 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 46.6 t80 -97.41 -30.9 0.25 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.01 178.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.68 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 77.8 Cg_exo -47.92 96.63 0.03 OUTLIER 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 122.099 1.866 . . . . 0.0 112.341 -178.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.442 ' O ' ' O ' ' A' ' 141' ' ' ASP . 90.9 mtm180 -137.68 -86.17 0.29 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.563 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.553 ' CG ' ' H ' ' A' ' 142' ' ' MET . 41.6 p-10 -55.71 -113.49 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.858 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' MET . . . . . 0.553 ' H ' ' CG ' ' A' ' 141' ' ' ASP . 18.3 tpp 61.39 -95.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.81 -37.25 86.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.842 0.353 . . . . 0.0 110.756 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -60.54 -38.17 83.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.09 0.471 . . . . 0.0 111.156 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -75.96 -34.54 59.83 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.621 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.554 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 18.8 m -62.1 -44.11 97.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.536 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 19.1 mtm -61.67 -44.03 97.74 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.5 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.8 mt -67.91 -49.57 61.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 78.2 t -62.56 -43.2 98.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.378 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 49.8 tp -58.98 -45.46 90.54 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.439 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.03 -42.53 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.043 0.449 . . . . 0.0 110.275 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 24.2 tp -59.16 -41.85 89.36 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.115 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.4 -44.32 97.35 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.545 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.26 -46.61 82.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.356 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.26 -43.98 80.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.102 0.477 . . . . 0.0 110.43 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.56 -38.7 91.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.128 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -60.52 -41.27 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.321 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 88.5 t -66.38 -45.11 90.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.559 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.15 -35.34 80.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.05 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 35.9 p -157.73 160.93 38.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.198 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.461 ' O ' ' O ' ' A' ' 163' ' ' THR . 55.2 m80 -128.39 50.05 2.12 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.369 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' THR . . . . . 0.461 ' O ' ' O ' ' A' ' 162' ' ' HIS . 14.4 p 56.95 147.84 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.0 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.433 ' O ' ' CB ' ' A' ' 165' ' ' SER . 56.8 Cg_endo -70.74 -91.01 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.64 0 C-N-CA 122.153 1.902 . . . . 0.0 111.75 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.6 m 164.68 -68.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.112 0.482 . . . . 0.0 110.348 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 16.9 tp -65.09 -41.52 94.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.939 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.518 ' N ' ' CD2' ' A' ' 167' ' ' LEU . 3.9 mm? -64.44 -25.5 68.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.806 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.09 -43.81 73.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.876 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -66.76 -46.93 73.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.028 0.442 . . . . 0.0 110.913 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.5 -44.27 94.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.421 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -61.49 -37.62 84.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.486 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.68 -49.71 76.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.411 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.2 m -59.13 -42.51 90.81 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.53 -42.47 87.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.224 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.6 t -61.76 -37.99 79.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.471 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -61.0 -41.12 95.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.867 0.365 . . . . 0.0 110.359 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -62.26 -47.33 84.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.111 0.481 . . . . 0.0 110.491 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 67.5 mt -70.26 -34.59 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.827 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . 0.407 ' O ' ' N ' ' A' ' 181' ' ' ASN . 52.5 m-20 -48.67 -34.18 11.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.556 -178.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -43.26 -24.83 0.1 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.947 0.404 . . . . 0.0 110.881 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 179' ' ' ASN . 56.1 t-20 -116.67 -48.91 2.66 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.011 -179.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.52 -36.05 77.45 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.519 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -51.81 -30.84 24.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.224 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 75.3 m -59.32 -51.42 70.01 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.836 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -70.6 -43.77 68.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.067 0.461 . . . . 0.0 110.889 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 69.6 t -64.35 -43.9 97.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.572 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.57 -45.2 92.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.562 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 37.6 m -59.22 -31.95 69.51 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.351 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.99 -44.19 97.24 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.181 -179.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -147.07 140.46 25.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.438 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -65.21 -43.23 92.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.743 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -83.39 113.43 20.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.454 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -63.62 -41.46 99.09 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 111.076 -0.809 . . . . 0.0 111.076 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 66.6 mtt -114.46 140.89 48.35 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.914 0.388 . . . . 0.0 110.522 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.3 p-10 . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.555 -179.842 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -63.06 -40.22 97.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.685 0.279 . . . . 0.0 110.482 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -79.37 132.81 36.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.409 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 m -73.06 135.36 44.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.394 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.454 ' O ' ' O ' ' A' ' 66' ' ' HIS . 94.9 p -106.29 -2.16 22.63 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.436 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.454 ' O ' ' O ' ' A' ' 65' ' ' SER . 68.6 m80 57.9 127.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 39.8 m -58.72 -34.99 71.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.574 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 48.15 74.58 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.566 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.8 mp -63.36 -43.33 98.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.442 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 43.83 -118.49 2.25 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 24.4 mmt85 -83.68 133.03 34.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.877 0.37 . . . . 0.0 110.167 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 10.1 tp -128.92 129.75 68.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.52 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 74' ' ' ALA . 97.1 mt-10 40.95 41.84 1.35 Allowed 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.579 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.571 ' C ' ' H ' ' A' ' 76' ' ' SER . . . 56.82 117.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.349 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 46.0 p-10 -61.13 2.96 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.496 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.571 ' H ' ' C ' ' A' ' 74' ' ' ALA . 47.6 t -60.64 -45.55 93.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.746 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -96.02 -71.75 0.66 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.534 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.4 ' C ' ' H ' ' A' ' 80' ' ' GLU . 12.3 t -45.38 -91.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.471 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 70.88 -49.04 0.67 Allowed 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.463 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.4 ' H ' ' C ' ' A' ' 78' ' ' SER . 48.1 mt-10 -69.36 -33.78 73.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.932 0.396 . . . . 0.0 110.871 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 81' ' ' ASP . 60.0 t0 -47.66 -32.0 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.634 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.483 ' CG2' ' N ' ' A' ' 83' ' ' ILE . 15.2 tt -61.39 -43.81 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.428 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.483 ' N ' ' CG2' ' A' ' 82' ' ' ILE . 96.6 mt -65.01 -43.54 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.138 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -50.7 -53.68 29.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.192 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -61.09 -42.08 97.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.598 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.6 mt -60.32 -52.02 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.064 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.24 93.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.194 0.521 . . . . 0.0 110.294 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -54.96 -45.57 74.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.196 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -65.22 -39.55 92.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mt -66.68 -37.97 85.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.422 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.82 -47.74 79.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.173 0.511 . . . . 0.0 110.19 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -62.12 -52.23 64.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -65.5 -27.49 41.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.355 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -64.1 -32.95 85.9 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.41 -44.4 92.86 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.578 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.4 p -161.62 89.54 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.917 0.389 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.5 mtm -60.94 -49.75 76.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.27 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.63 ' C ' ' H ' ' A' ' 100' ' ' SER . 67.8 t0 -176.85 123.81 0.15 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.312 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.6 mtm180 -55.41 1.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.63 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.6 t -59.59 -42.86 93.52 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.601 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.461 ' C ' ' O ' ' A' ' 100' ' ' SER . 3.0 pt -28.95 94.64 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.512 0 O-C-N 123.636 0.585 . . . . 0.0 110.925 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.456 ' O ' ' O ' ' A' ' 103' ' ' PRO . 70.9 Cg_exo -45.92 108.45 0.15 Allowed 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.246 1.964 . . . . 0.0 112.074 -178.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.456 ' O ' ' O ' ' A' ' 102' ' ' PRO . 60.3 Cg_exo -49.56 -170.47 0.0 OUTLIER 'Trans proline' 0 N--CA 1.493 1.489 0 C-N-CA 122.258 1.972 . . . . 0.0 112.132 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 91.13 -60.57 3.03 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.699 -0.961 . . . . 0.0 110.699 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.509 ' CD1' ' N ' ' A' ' 105' ' ' LEU . 7.5 mp -64.44 -43.01 95.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.042 0.449 . . . . 0.0 110.283 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 90.9 t -50.47 -41.7 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.946 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -57.72 -48.31 79.96 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.284 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.49 -51.1 58.65 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.92 -41.2 99.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.005 0.431 . . . . 0.0 110.121 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.69 -39.96 78.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.066 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.55 -44.29 96.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.516 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -68.01 -48.22 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.567 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 tp -61.35 -23.06 65.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.627 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -74.13 -43.99 55.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.795 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -63.23 -41.55 99.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.922 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.5 t -97.24 35.08 1.65 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.348 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.545 ' C ' ' H ' ' A' ' 119' ' ' SER . 21.8 m -66.86 -14.62 62.92 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.38 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.8 ptt85 -71.25 16.95 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.71 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.545 ' H ' ' C ' ' A' ' 117' ' ' SER . 58.3 m 56.78 95.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -63.54 128.62 36.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.432 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -89.98 -3.27 58.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.302 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -78.44 45.59 0.58 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.665 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -103.92 -34.39 8.51 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.903 0.382 . . . . 0.0 110.569 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.459 ' C ' ' H ' ' A' ' 126' ' ' ASP . 28.8 t-20 -64.88 -37.64 88.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.659 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.464 ' O ' ' N ' ' A' ' 129' ' ' THR . 9.6 ptp180 -50.75 -12.09 0.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.796 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.459 ' H ' ' C ' ' A' ' 124' ' ' ASN . 93.7 m-20 -50.3 -49.12 54.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.807 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.515 ' N ' ' CD2' ' A' ' 127' ' ' LEU . 4.0 mm? -71.63 -43.45 66.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.041 0.448 . . . . 0.0 110.855 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.6 70.18 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.445 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.464 ' N ' ' O ' ' A' ' 125' ' ' ARG . 96.7 m -57.47 -51.49 69.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.356 -179.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.21 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.04 0.448 . . . . 0.0 110.604 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.68 -47.02 82.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.411 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -56.2 -41.84 76.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.284 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -58.24 -45.46 87.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.8 -47.21 75.86 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.231 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.37 -33.76 76.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.628 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -56.66 -31.71 64.67 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.114 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -134.23 61.66 1.67 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.76 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.481 ' O ' ' CD2' ' A' ' 138' ' ' TYR . 89.2 t80 -165.42 71.89 1.36 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.74 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.422 ' O ' ' O ' ' A' ' 140' ' ' ARG . 60.5 Cg_endo -80.13 -83.43 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.722 2.282 . . . . 0.0 112.127 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.422 ' O ' ' O ' ' A' ' 139' ' ' PRO . 77.9 mmt-85 59.94 126.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.68 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.549 ' O ' ' N ' ' A' ' 143' ' ' GLU . 99.6 m-20 -65.69 -34.14 77.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.799 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.8 mtm 61.24 -64.26 0.07 Allowed 'General case' 0 N--CA 1.463 0.196 0 O-C-N 123.803 0.69 . . . . 0.0 110.85 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.549 ' N ' ' O ' ' A' ' 141' ' ' ASP . 10.1 pt-20 -51.3 -46.35 62.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.424 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . 0.467 ' N ' ' CG ' ' A' ' 143' ' ' GLU . 88.1 tttt -62.88 -48.56 78.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.258 0.551 . . . . 0.0 109.985 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.82 -46.8 77.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.865 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 33.7 mtpt -65.98 -39.47 90.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.783 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 76.8 m -59.94 -47.8 84.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.749 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 74.1 mtm -61.4 -42.12 98.22 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.533 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.54 -43.33 85.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.809 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 64.6 t -67.97 -50.51 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.391 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.87 -44.2 96.74 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.001 0.429 . . . . 0.0 110.773 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.51 -37.74 88.48 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.19 -40.65 96.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.508 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.7 -49.46 77.42 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.789 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.424 ' N ' ' CD2' ' A' ' 155' ' ' LEU . 4.1 mm? -65.32 -43.4 91.13 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.715 179.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.43 -42.9 82.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.343 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -67.52 -36.73 81.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.344 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.13 -41.97 97.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.551 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 75.5 t -63.62 -45.35 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.681 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -59.62 -51.15 71.06 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.119 -0.633 . . . . 0.0 110.01 -179.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.44 ' O ' ' C ' ' A' ' 162' ' ' HIS . 17.5 t 35.02 -120.55 0.11 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.296 0.373 . . . . 0.0 110.631 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.44 ' C ' ' O ' ' A' ' 161' ' ' SER . 78.9 m-70 31.75 78.78 0.03 OUTLIER 'General case' 0 C--N 1.341 0.217 0 O-C-N 123.216 0.322 . . . . 0.0 111.555 178.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' THR . . . . . 0.437 ' CG2' ' HE ' ' A' ' 168' ' ' ARG . 17.9 m -129.61 80.58 71.51 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.237 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.97 149.88 67.78 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.904 2.403 . . . . 0.0 111.959 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 13.6 p -57.09 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.763 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 21.8 tp 67.87 -51.45 0.52 Allowed 'General case' 0 C--O 1.233 0.212 0 O-C-N 123.897 0.748 . . . . 0.0 110.191 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 51.5 tp -60.08 -43.6 95.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.933 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.437 ' HE ' ' CG2' ' A' ' 163' ' ' THR . 99.8 mtt180 -66.59 -37.88 85.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.691 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.52 -47.0 88.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.72 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.421 ' O ' ' OG1' ' A' ' 174' ' ' THR . 80.8 t -68.37 -43.15 84.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.298 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -58.4 -46.68 85.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.691 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . 0.403 ' CD2' ' O ' ' A' ' 168' ' ' ARG . 72.1 m-70 -65.03 -48.81 72.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.943 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.97 -45.92 89.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 24.4 m -53.35 -44.82 68.83 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.152 0.501 . . . . 0.0 110.214 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.73 -43.13 90.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.421 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -58.77 -39.71 81.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -60.05 -44.04 94.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.262 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 36.1 mm -64.04 -41.97 94.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.029 0.442 . . . . 0.0 110.537 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 180' ' ' GLN . 59.9 t-20 -49.89 -34.44 20.26 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.809 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . 0.461 ' O ' ' O ' ' A' ' 179' ' ' ASN . 88.2 mt-30 -36.41 -96.71 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.798 0.332 . . . . 0.0 111.248 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -127.21 -15.24 5.26 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.901 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . 0.461 ' CD1' ' N ' ' A' ' 182' ' ' LEU . 9.7 mp -64.65 -39.37 93.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.518 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -53.03 -32.69 48.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.613 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 20.2 m -57.22 -47.67 80.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.962 0.411 . . . . 0.0 110.6 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -67.55 -35.58 79.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.531 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 88.2 t -64.77 -43.9 96.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.549 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 87.8 mtm180 -60.34 -48.99 79.38 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.552 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 67.0 m -61.43 -42.36 98.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.851 0.358 . . . . 0.0 110.637 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 4.9 tp -99.26 39.48 1.29 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.578 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.31 -37.81 88.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.618 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 91.7 mtm180 -76.02 137.3 40.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.579 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 39.8 p30 -156.74 168.89 26.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.629 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -65.86 -40.09 95.34 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 46.0 ttp -61.69 -42.64 99.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.735 0.302 . . . . 0.0 110.433 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 25.0 t0 . . . . . 0 C--O 1.219 -0.529 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.566 -179.915 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -90.7 5.66 47.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.787 0.327 . . . . 0.0 110.575 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -80.11 140.28 36.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.701 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.9 m -88.05 -3.96 58.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.319 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 58.6 m -58.45 -42.62 87.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.633 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -100.27 75.23 1.79 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.456 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 38.7 t -63.12 -43.79 97.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.512 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -88.82 138.43 31.42 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.705 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.7 mt -63.93 -41.88 97.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.465 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 145.39 -59.62 0.5 Allowed Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.428 ' O ' ' O ' ' A' ' 72' ' ' ILE . 43.4 ttm180 -66.53 -18.32 65.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.858 0.361 . . . . 0.0 110.373 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.594 ' C ' ' H ' ' A' ' 74' ' ' ALA . 7.9 mm -61.05 -127.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.197 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 67.83 -33.8 0.23 Allowed 'General case' 0 CA--C 1.529 0.164 0 O-C-N 123.482 0.489 . . . . 0.0 110.548 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.594 ' H ' ' C ' ' A' ' 72' ' ' ILE . . . -65.6 -36.57 84.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.613 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -87.96 11.52 15.64 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.416 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 98.8 p -58.46 -20.84 48.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.551 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -61.85 -72.75 0.11 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.606 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.408 ' C ' ' H ' ' A' ' 80' ' ' GLU . 46.1 t -62.61 -44.3 96.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.654 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -58.61 -8.39 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.567 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.408 ' H ' ' C ' ' A' ' 78' ' ' SER . 81.3 tt0 -62.23 -36.77 83.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.396 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -60.21 -48.29 82.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.432 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.3 mt -66.44 -43.68 90.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.447 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.31 -43.63 98.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.238 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 78.6 ttt-85 -56.09 -48.04 76.87 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -60.79 -42.74 98.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.038 0.447 . . . . 0.0 110.658 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.413 HD11 HG23 ' A' ' 86' ' ' ILE . 82.9 mt -60.52 -45.38 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.05 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.64 -39.04 93.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.119 0.485 . . . . 0.0 110.197 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -56.69 -48.62 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.906 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.24 -45.85 89.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.246 0.546 . . . . 0.0 110.49 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.522 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.1 mt -63.8 -39.41 94.18 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.462 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.479 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.39 -46.9 76.54 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.417 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.6 tp60 -64.53 -52.38 58.02 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.163 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.7 t -65.32 -25.96 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.392 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.16 -32.38 14.33 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.404 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.479 ' N ' ' O ' ' A' ' 91' ' ' ALA . 64.7 t0 -70.69 -46.85 62.39 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.999 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.563 ' C ' ' H ' ' A' ' 98' ' ' ASP . 57.4 m -51.34 -105.93 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.815 0.34 . . . . 0.0 110.991 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 mmt 55.38 4.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.213 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.563 ' H ' ' C ' ' A' ' 96' ' ' SER . 98.1 m-20 -76.45 -67.11 0.72 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.344 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -90.09 -30.39 17.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.632 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.9 m -87.81 94.4 9.75 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.261 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -153.55 157.32 32.74 Favored Pre-proline 0 CA--C 1.533 0.298 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.979 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -82.1 162.0 17.97 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 C-N-CA 122.426 2.084 . . . . 0.0 112.653 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.638 ' C ' ' H ' ' A' ' 105' ' ' LEU . 54.1 Cg_exo -40.31 129.5 2.37 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 C-N-CA 122.895 2.396 . . . . 0.0 112.27 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -59.68 9.79 0.04 OUTLIER Glycine 0 CA--C 1.528 0.905 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.638 ' H ' ' C ' ' A' ' 103' ' ' PRO . 3.7 mm? -67.46 -39.32 85.31 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.946 0.403 . . . . 0.0 110.288 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.456 ' CG1' ' N ' ' A' ' 107' ' ' ASN . 14.5 p -58.96 -48.44 86.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.405 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.456 ' N ' ' CG1' ' A' ' 106' ' ' VAL . 36.3 t30 -57.46 -34.37 68.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.361 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.79 -39.66 95.27 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 51.3 tp -60.43 -42.05 95.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 110.695 -179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.82 -48.8 80.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.149 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.06 -42.26 76.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.245 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -50.84 -37.54 43.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.79 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' A' ' 117' ' ' SER . 64.6 mt -62.33 -43.28 99.2 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.199 -0.6 . . . . 0.0 109.992 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.446 ' O ' ' OG ' ' A' ' 117' ' ' SER . 44.5 ttm180 -55.65 -41.95 74.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.0 110.03 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -63.2 -39.78 95.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.387 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.494 ' C ' ' H ' ' A' ' 118' ' ' ARG . 45.0 p -85.06 -10.51 56.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.755 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.446 ' OG ' ' O ' ' A' ' 114' ' ' ARG . 59.7 p -74.61 19.01 0.14 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.378 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.494 ' H ' ' C ' ' A' ' 116' ' ' THR . 16.7 ptm180 -60.64 -35.27 75.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.444 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 37.6 m -65.01 -21.87 66.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.877 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 26.8 tp10 73.42 -54.64 0.69 Allowed 'General case' 0 C--O 1.232 0.164 0 O-C-N 123.706 0.629 . . . . 0.0 110.382 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 56.2 25.96 9.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.938 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -97.67 2.01 49.29 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.47 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -64.94 -49.97 68.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.894 0.378 . . . . 0.0 110.501 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -69.37 -39.06 78.27 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.648 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.405 ' O ' ' O ' ' A' ' 126' ' ' ASP . 71.5 ttt180 -59.87 -30.7 69.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.777 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 125' ' ' ARG . 33.8 t0 -37.12 -94.48 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.77 -178.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.614 HD11 ' H ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -49.23 -28.69 4.83 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.732 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.614 ' H ' HD11 ' A' ' 127' ' ' LEU . . . -56.58 -39.58 73.75 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.14 0.495 . . . . 0.0 109.971 -178.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 88.0 m -61.79 -42.37 98.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.697 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.15 79.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.227 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -58.93 -44.91 91.45 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.385 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -67.06 -45.96 75.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.067 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -64.97 -37.0 86.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.78 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.6 tp -59.28 -54.49 46.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.362 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.77 -38.5 90.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.719 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -56.24 -31.95 64.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.435 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -134.92 94.24 3.13 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 110.366 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.572 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 72.4 t80 -155.14 44.51 0.23 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.882 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 58.8 Cg_endo -71.14 -14.69 31.9 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.762 2.308 . . . . 0.0 112.116 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -83.55 -175.5 5.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.57 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.4 t0 66.95 54.56 0.77 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.976 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' MET . . . . . 0.459 ' CG ' ' N ' ' A' ' 143' ' ' GLU . 12.8 ptm -165.87 -43.44 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.384 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 142' ' ' MET . 81.4 tt0 -66.64 -42.87 86.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.021 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.59 -29.8 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.684 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.55 -50.31 63.58 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.605 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -72.85 -30.16 63.78 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.827 -0.545 . . . . 0.0 110.819 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 68.4 m -60.24 -46.22 90.52 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.314 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 66.4 mtt -64.91 -46.58 81.1 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.581 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.5 mp -66.09 -47.29 74.73 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.032 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.51 -43.66 98.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.038 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.3 tp -53.12 -46.3 68.71 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.2 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.33 -35.98 82.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tp -59.25 -44.83 92.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.536 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.83 -44.41 96.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.048 0.451 . . . . 0.0 110.143 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.3 -43.74 90.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.055 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.69 -44.99 69.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.686 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.427 ' O ' ' O ' ' A' ' 161' ' ' SER . 25.9 tptp -61.99 -40.59 96.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.572 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -62.39 -45.47 93.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.37 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.75 -43.99 82.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.687 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.94 -37.44 87.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.179 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 157' ' ' LYS . 41.1 t -172.36 176.84 3.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.275 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -128.2 142.67 51.1 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.829 0.347 . . . . 0.0 110.124 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' THR . . . . . 0.511 ' CB ' HH21 ' A' ' 168' ' ' ARG . 1.1 p -84.89 153.41 60.44 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.586 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.22 -162.38 0.1 OUTLIER 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 122.592 2.195 . . . . 0.0 111.83 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 61.6 p -146.34 90.02 1.91 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.478 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 47.9 tp -174.15 -70.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.492 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 55.1 mt -64.5 -26.97 68.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.307 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.511 HH21 ' CB ' ' A' ' 163' ' ' THR . 63.1 ttm-85 -60.06 -45.59 92.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.24 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.79 -46.03 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.935 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 75.6 t -63.22 -45.3 98.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.438 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -61.12 -38.23 85.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.095 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -59.75 -46.83 87.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.591 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.7 m -61.24 -46.99 88.1 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.6 m -52.59 -43.71 65.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.446 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 72.1 t -62.69 -43.41 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.292 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . 0.444 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 54.7 t-20 -71.77 -32.56 67.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.292 0.568 . . . . 0.0 110.649 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -58.94 -43.34 91.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.553 -179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.423 HG23 HD13 ' A' ' 178' ' ' ILE . 97.1 mt -62.35 -42.61 96.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.583 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . 0.421 ' O ' ' O ' ' A' ' 180' ' ' GLN . 93.9 m-20 -51.49 -34.18 34.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.647 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . 0.49 ' O ' ' ND2' ' A' ' 181' ' ' ASN . 59.4 tt0 -36.66 -93.84 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.628 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . 0.49 ' ND2' ' O ' ' A' ' 180' ' ' GLN . 16.2 m120 -151.45 4.64 0.44 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.124 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 10.9 mp -48.55 -36.52 15.6 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.595 0.236 . . . . 0.0 110.626 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . 0.403 HH12 ' HA ' ' A' ' 179' ' ' ASN . 90.1 mtm-85 -51.75 -49.71 62.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.342 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 96.7 m -66.78 -49.65 65.21 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.106 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -62.3 -43.89 97.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.704 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.411 ' O ' ' O ' ' A' ' 189' ' ' LEU . 46.8 t -59.59 -42.97 89.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.005 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -56.2 -53.88 51.91 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.797 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 9.9 p -62.83 -41.47 99.35 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.591 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.455 ' CD2' ' N ' ' A' ' 189' ' ' LEU . 4.2 mm? -89.15 -172.2 3.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.345 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . 56.19 55.99 6.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.36 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -62.85 -44.13 96.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.455 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -82.28 157.08 23.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.549 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -170.37 172.14 43.9 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 50.1 ttp -135.2 146.71 48.95 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.901 0.381 . . . . 0.0 110.413 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 34.5 t70 . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.496 -179.947 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.2 m120 57.88 34.45 24.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.949 0.404 . . . . 0.0 110.479 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? 45.43 85.3 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.037 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 97.9 p -156.14 163.01 40.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.604 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 96.9 p -160.04 164.9 32.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.403 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -111.56 143.74 41.93 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.414 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 68.5 m -75.07 151.87 38.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.644 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 67.8 ttp85 -81.66 140.5 34.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.424 ' CD1' ' N ' ' A' ' 69' ' ' LEU . 10.5 mp -95.58 111.65 23.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.985 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -92.28 -100.8 1.39 Allowed Glycine 0 CA--C 1.521 0.421 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -83.28 124.94 31.08 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 70.5 mt -94.64 97.01 6.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.21 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 39.47 60.23 1.62 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.887 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.469 ' O ' ' N ' ' A' ' 76' ' ' SER . . . 50.66 -138.68 0.99 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.273 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 46.65 15.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.668 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 74' ' ' ALA . 90.1 p -110.59 8.55 22.88 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.472 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.54 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.1 mp0 -98.93 -1.11 40.8 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.581 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.9 t -156.58 46.8 0.44 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.704 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -172.85 -73.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.36 -35.55 81.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.187 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -61.61 -41.52 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.493 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.403 HD12 HG22 ' A' ' 82' ' ' ILE . 22.1 mm -62.06 -49.06 85.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.104 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.6 -42.53 94.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.167 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -51.46 -54.59 25.34 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.882 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -53.89 -44.02 70.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.944 0.402 . . . . 0.0 110.912 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.4 -49.88 80.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 120.288 -0.565 . . . . 0.0 109.511 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.483 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -60.37 -37.69 81.53 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.948 -179.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -58.56 -47.19 85.05 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.561 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -68.88 -46.98 67.0 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.223 0.535 . . . . 0.0 110.854 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.71 -35.47 78.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.771 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.483 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -64.1 -42.74 96.78 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.408 ' NE2' ' C ' ' A' ' 92' ' ' GLN . 0.6 OUTLIER -64.05 -52.72 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.509 -179.572 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.3 p -73.67 -27.09 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.216 0.531 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -78.37 -35.8 32.36 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.74 -47.05 82.58 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.788 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.9 m -163.48 143.59 8.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.34 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 ttm -72.41 98.44 2.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.286 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.452 ' O ' ' CB ' ' A' ' 99' ' ' ARG . 66.4 t0 41.75 42.59 2.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.317 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.452 ' CB ' ' O ' ' A' ' 98' ' ' ASP . 7.9 tpt180 80.07 -74.18 0.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.307 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.7 p 176.55 84.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.749 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.699 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 1.4 mp -94.06 -30.38 0.29 Allowed Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.548 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.699 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 37.4 Cg_exo -57.51 166.4 4.82 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 C-N-CA 122.15 1.9 . . . . 0.0 111.844 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.52 ' C ' ' H ' ' A' ' 105' ' ' LEU . 75.3 Cg_exo -47.3 163.64 0.15 Allowed 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.437 2.092 . . . . 0.0 112.266 178.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -60.45 1.26 0.72 Allowed Glycine 0 CA--C 1.527 0.813 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.52 ' H ' ' C ' ' A' ' 103' ' ' PRO . 59.6 mt -62.28 -38.89 91.08 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.766 0.317 . . . . 0.0 110.525 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 99.3 t -61.21 -45.1 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.215 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -62.7 -41.4 99.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.92 -21.94 11.2 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.7 mt -61.53 -40.05 93.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.77 0.319 . . . . 0.0 110.579 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.14 -44.79 44.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.679 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.506 ' N ' ' CD2' ' A' ' 111' ' ' LEU . 3.9 mm? -65.67 -34.73 78.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.928 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -69.03 -47.16 66.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.388 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.99 -42.92 97.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.225 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -63.03 -46.2 88.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.195 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -70.81 -40.63 72.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.2 m -92.86 18.3 9.21 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.4 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.9 p -62.2 -20.28 64.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.463 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -62.92 -30.61 71.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.674 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.4 m -63.88 -105.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -174.01 -57.81 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.491 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 64.36 40.88 6.17 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.461 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -111.01 10.67 22.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.059 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -59.67 -44.47 93.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.086 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -66.37 -41.64 89.18 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.103 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -80.26 -4.24 52.48 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.378 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -42.27 -67.89 0.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.0 -40.46 91.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 120.796 0.332 . . . . 0.0 111.149 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -38.72 66.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.494 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 55.8 m -72.91 -42.77 63.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.75 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.02 87.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.079 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.9 -47.12 86.4 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.83 0.348 . . . . 0.0 110.716 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -55.07 -41.12 71.09 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.18 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -67.92 -38.47 82.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.661 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.74 -54.46 46.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.595 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.47 ' CD1' ' N ' ' A' ' 135' ' ' LEU . 8.2 mp -65.32 -40.26 93.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.012 0.434 . . . . 0.0 110.614 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . 0.647 ' NE2' HH22 ' A' ' 140' ' ' ARG . 82.0 mm-40 -66.93 -33.22 75.1 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.341 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.07 -50.89 71.94 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.039 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.55 ' CE2' ' O ' ' A' ' 139' ' ' PRO . 0.1 OUTLIER -109.37 150.56 41.28 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.763 -179.403 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.55 ' O ' ' CE2' ' A' ' 138' ' ' TYR . 55.9 Cg_endo -72.26 156.62 54.87 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.405 2.07 . . . . 0.0 111.584 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.647 HH22 ' NE2' ' A' ' 136' ' ' GLN . 0.6 OUTLIER -94.26 8.13 42.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.412 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -63.07 129.59 41.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.238 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.9 mtt -116.73 3.81 13.02 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.336 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -63.61 -34.81 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.785 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -60.9 -38.09 84.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.006 0.431 . . . . 0.0 110.241 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -62.04 -45.55 93.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.424 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.92 -32.94 74.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 19.3 m -58.92 -45.46 90.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.259 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.7 mtt -63.16 -45.98 89.32 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.658 -0.417 . . . . 0.0 109.954 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.95 -42.65 80.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 42.9 t -62.71 -43.17 98.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.285 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.27 -47.49 85.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.429 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.99 87.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.181 0.515 . . . . 0.0 109.728 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 5.6 tp -59.08 -40.77 86.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.168 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 29.1 mt -61.22 -44.73 96.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.966 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.7 -46.45 82.32 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.181 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.18 96.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.15 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -63.38 -38.94 93.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.301 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -58.17 -42.32 85.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.717 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.5 t -65.59 -46.07 90.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.281 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -69.1 -32.89 72.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.047 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 11.3 t -31.39 94.7 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.124 0.488 . . . . 0.0 110.996 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.511 ' CG ' ' O ' ' A' ' 161' ' ' SER . 89.2 m-70 -159.83 41.91 0.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.151 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' THR . . . . . 0.544 ' N ' ' CD ' ' A' ' 164' ' ' PRO . 0.5 OUTLIER -128.25 48.12 3.26 Favored Pre-proline 0 N--CA 1.466 0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.351 179.507 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 163' ' ' THR . 36.4 Cg_endo -66.1 140.71 60.73 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.503 2.136 . . . . 0.0 111.738 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.4 m 162.03 -177.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.432 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . 0.515 ' N ' ' CD2' ' A' ' 166' ' ' LEU . 3.8 mm? -77.55 -10.76 59.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.554 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 pp -61.6 -27.52 68.71 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.466 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -62.09 -47.09 86.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . 0.4 ' OD1' ' O ' ' A' ' 169' ' ' ASP . 66.7 t0 -66.71 -38.71 87.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.54 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 84.8 t -61.95 -46.51 96.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.586 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -61.21 -41.3 96.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.837 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.95 -49.71 76.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.501 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 85.2 m -60.07 -42.47 94.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.547 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.2 m -56.31 -43.19 78.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.435 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.0 t -61.33 -43.13 96.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.542 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -67.65 -41.79 83.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.797 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . 0.467 ' O ' ' O ' ' A' ' 180' ' ' GLN . 4.7 m-85 -64.26 -36.15 83.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.541 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 2.5 mm -54.91 -35.68 35.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.483 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -55.25 -53.76 51.99 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.577 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . 0.467 ' O ' ' O ' ' A' ' 177' ' ' PHE . 99.1 mt-30 -100.9 138.31 38.13 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.392 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 71.1 50.47 0.31 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.322 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 53.9 tp -67.4 -41.02 85.64 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.739 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -56.73 -32.78 65.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.415 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 69.3 m -61.0 -49.07 78.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -68.91 -42.22 77.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.027 0.441 . . . . 0.0 110.316 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.98 -42.69 97.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.682 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -58.95 -44.73 91.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.298 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.3 t -61.23 -44.48 97.2 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.775 0.321 . . . . 0.0 110.518 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 50.8 tp -63.27 -43.58 97.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.55 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . 0.541 ' O ' ' N ' ' A' ' 192' ' ' ASN . . . -72.95 -70.46 0.35 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.481 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 41.19 -88.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.795 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.541 ' N ' ' O ' ' A' ' 190' ' ' ALA . 40.4 t30 -63.41 -41.23 98.71 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.434 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . 0.531 ' O ' ' N ' ' A' ' 195' ' ' ASP . . . 57.3 30.19 61.04 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 43.7 ttm 57.21 -78.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.761 0.315 . . . . 0.0 110.488 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . 0.531 ' N ' ' O ' ' A' ' 193' ' ' GLY . 54.9 p-10 . . . . . 0 C--O 1.219 -0.527 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.463 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -85.58 114.19 22.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.827 0.346 . . . . 0.0 110.265 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 73.7 ttp85 -126.55 127.94 46.08 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.087 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.2 m 40.03 72.03 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.896 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.6 t -61.56 -43.27 99.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.442 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.485 ' CG ' ' N ' ' A' ' 67' ' ' SER . 86.0 t60 -153.04 160.93 43.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.518 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.485 ' N ' ' CG ' ' A' ' 66' ' ' HIS . 29.2 p -157.14 165.23 36.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.739 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -68.87 138.67 54.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.441 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.4 ' C ' ' CD2' ' A' ' 69' ' ' LEU . 3.2 tt -145.02 96.55 2.87 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.445 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -103.1 -178.8 26.43 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 48.92 82.72 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.705 0.288 . . . . 0.0 110.621 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.531 ' O ' ' N ' ' A' ' 74' ' ' ALA . 19.0 tt -137.72 76.89 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.593 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.512 ' N ' ' OE1' ' A' ' 73' ' ' GLU . 57.5 mp0 40.38 21.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.756 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.531 ' N ' ' O ' ' A' ' 72' ' ' ILE . . . -167.36 161.23 14.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.484 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 55.31 16.12 1.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.745 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 59.7 p -91.36 -4.59 55.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.175 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -54.16 -35.64 62.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.377 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.0 m -126.72 -160.99 1.03 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.347 -0.388 . . . . 0.0 109.956 179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? 70.92 -56.52 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -65.22 -33.82 76.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.0 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -58.48 -45.4 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.525 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.46 -43.77 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.408 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.7 mt -62.41 -43.36 98.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -53.46 -53.18 55.09 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -58.1 -42.37 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.699 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.54 -51.59 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.011 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -61.81 -38.2 87.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.338 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -55.96 -47.51 77.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.607 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -66.23 -45.17 81.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.507 . . . . 0.0 110.826 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.478 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.3 mt -68.44 -33.6 74.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.471 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.46 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -58.78 -46.48 87.45 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.132 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.32 -51.99 60.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.077 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.39 -26.16 38.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.478 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.17 -22.96 42.59 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -63.13 -43.85 97.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.703 0.287 . . . . 0.0 111.077 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.589 ' C ' ' H ' ' A' ' 98' ' ' ASP . 32.7 t -165.83 -75.88 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.581 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.9 tpt 66.67 -14.25 0.16 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.358 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.589 ' H ' ' C ' ' A' ' 96' ' ' SER . 95.1 m-20 -72.03 -19.45 61.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.219 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -68.89 -41.22 78.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.68 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 77.0 p -63.7 -42.96 97.9 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.731 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.469 ' O ' ' O ' ' A' ' 98' ' ' ASP . 38.9 mt -110.93 129.56 23.84 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.943 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.509 ' O ' ' N ' ' A' ' 104' ' ' GLY . 73.0 Cg_endo -74.04 161.32 41.29 Favored 'Trans proline' 0 N--CA 1.493 1.458 0 C-N-CA 122.383 2.055 . . . . 0.0 112.512 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.498 ' O ' ' N ' ' A' ' 105' ' ' LEU . 85.2 Cg_exo -39.2 -22.37 0.08 OUTLIER 'Trans proline' 0 C--N 1.311 -1.447 0 C-N-CA 122.826 2.35 . . . . 0.0 112.077 178.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.616 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . 44.3 17.86 0.09 OUTLIER Glycine 0 CA--C 1.521 0.455 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.498 ' N ' ' O ' ' A' ' 103' ' ' PRO . 10.9 mp 58.64 -4.25 0.07 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.539 0.209 . . . . 0.0 110.484 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.616 ' H ' ' C ' ' A' ' 104' ' ' GLY . 69.2 t -64.92 -45.79 93.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.947 0.403 . . . . 0.0 110.249 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -64.22 -32.19 73.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.999 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -61.6 -35.25 90.86 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.03 -38.29 88.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.539 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -56.97 -47.56 80.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.385 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 5.1 tt -65.53 -46.24 80.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.586 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -50.86 -36.35 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.647 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.494 ' O ' ' N ' ' A' ' 117' ' ' SER . 80.4 mt -61.49 -42.98 99.61 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.234 -0.586 . . . . 0.0 109.663 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.442 ' O ' ' OG ' ' A' ' 117' ' ' SER . 44.8 ttm180 -56.5 -42.54 78.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 110.151 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.86 -37.84 88.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.305 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.552 ' C ' ' H ' ' A' ' 118' ' ' ARG . 46.1 p -88.6 -12.52 42.38 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.755 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.494 ' N ' ' O ' ' A' ' 113' ' ' LEU . 83.5 p -70.83 34.11 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.666 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.552 ' H ' ' C ' ' A' ' 116' ' ' THR . 35.7 mmt180 -64.01 -35.68 81.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.211 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.531 ' C ' ' H ' ' A' ' 121' ' ' GLU . 52.8 p -67.33 8.86 0.27 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.683 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.557 ' C ' ' H ' ' A' ' 122' ' ' ASP . 55.9 mm-40 68.11 -42.81 0.47 Allowed 'General case' 0 C--O 1.231 0.094 0 O-C-N 123.58 0.55 . . . . 0.0 110.441 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.531 ' H ' ' C ' ' A' ' 119' ' ' SER . 95.7 mt-10 56.83 2.63 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.385 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.557 ' H ' ' C ' ' A' ' 120' ' ' GLU . 16.4 m-20 -127.87 -2.54 5.91 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.306 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -62.52 -41.45 98.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.619 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.593 ' C ' ' H ' ' A' ' 126' ' ' ASP . 7.3 m120 -66.3 -66.35 0.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.964 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.53 ' NH2' ' OD1' ' A' ' 122' ' ' ASP . 15.6 ptt180 -62.92 7.8 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.845 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.593 ' H ' ' C ' ' A' ' 124' ' ' ASN . 65.7 t0 -62.45 -38.83 91.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.706 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.552 ' N ' ' CD2' ' A' ' 127' ' ' LEU . 3.6 mm? -71.49 -42.96 67.42 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.141 0.496 . . . . 0.0 111.16 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.85 -28.73 69.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.567 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 125' ' ' ARG . 6.0 m -60.42 -49.85 75.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.154 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.14 -45.65 90.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.29 -41.99 96.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.644 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -55.33 -45.02 76.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.138 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -61.91 -47.05 86.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.726 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.4 tp -64.5 -49.12 72.58 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.456 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.08 -31.95 67.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.231 0.539 . . . . 0.0 110.214 -178.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.91 -25.76 44.42 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.681 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -108.68 -114.15 0.29 Allowed 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 29.3 t80 64.23 59.32 1.64 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.95 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.451 ' O ' ' O ' ' A' ' 140' ' ' ARG . 60.9 Cg_endo -75.48 -10.28 20.4 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.538 2.158 . . . . 0.0 110.845 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 139' ' ' PRO . 92.9 mtt180 -51.38 -171.87 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.523 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 56.57 48.56 16.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.667 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 64.4 mtt -144.6 -63.15 0.36 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.748 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -65.23 -44.6 87.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.009 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.13 -34.15 77.72 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.148 -179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -64.92 -43.32 93.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.069 0.462 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -66.46 -36.18 82.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.582 179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 58.5 m -58.56 -43.77 89.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.262 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mmm -61.36 -46.56 89.72 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.356 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.0 -43.82 81.91 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.122 0.487 . . . . 0.0 110.673 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 47.1 t -60.68 -45.28 97.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.563 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 36.3 mt -58.13 -45.66 86.95 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.434 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.85 -40.43 91.72 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.389 -0.525 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.23 -45.28 84.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.267 -178.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.54 -44.04 97.77 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.746 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 tt -65.08 -51.66 60.14 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.031 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.68 -41.87 98.1 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.758 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -63.79 -36.73 84.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.311 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -62.32 -39.36 92.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.385 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.9 t -67.89 -49.47 68.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.668 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.483 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -70.89 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.325 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.513 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 38.5 t -24.7 90.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.812 0.695 . . . . 0.0 111.186 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.513 ' CG ' ' O ' ' A' ' 161' ' ' SER . 70.3 m-70 -160.74 38.25 0.16 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.423 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 p -101.26 150.41 37.13 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.631 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.63 166.08 30.54 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 122.807 2.338 . . . . 0.0 111.782 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 41.3 t -108.58 100.87 10.07 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.645 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 58.2 tp -172.74 -80.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.535 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 62.0 mt -62.4 -25.93 68.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.371 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -60.59 -45.45 93.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.099 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -65.48 -42.02 92.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.583 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 83.6 t -62.3 -44.64 99.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.325 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.17 -40.61 81.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -60.69 -44.48 96.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.418 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 11.9 m -64.89 -40.24 94.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.795 0.331 . . . . 0.0 110.618 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.7 m -58.35 -50.74 72.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.984 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.9 -33.36 61.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.584 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -71.34 -39.7 71.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.062 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -61.84 -39.72 92.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.721 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 93.7 mt -59.92 -41.56 86.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.563 -179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 180' ' ' GLN . 95.7 m-20 -49.57 -34.13 16.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.006 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . 0.432 ' O ' ' O ' ' A' ' 179' ' ' ASN . 99.0 mm-40 -38.01 -95.96 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.029 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -128.73 -16.76 4.16 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.984 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . 0.467 ' CD1' ' N ' ' A' ' 182' ' ' LEU . 9.8 mp -62.55 -36.41 82.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.796 0.332 . . . . 0.0 110.191 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -51.79 -43.72 63.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.471 -177.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.1 m -61.86 -52.25 64.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.81 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -66.65 -41.65 87.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.004 0.431 . . . . 0.0 110.965 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 74.6 t -64.19 -43.44 97.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.554 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -57.68 -52.52 65.11 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.449 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 57.1 m -58.48 -49.04 78.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.701 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.512 ' C ' ' H ' ' A' ' 191' ' ' ARG . 49.2 tp -176.57 149.61 0.8 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.425 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -70.21 10.61 0.42 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.358 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . 0.512 ' H ' ' C ' ' A' ' 189' ' ' LEU . 78.4 ttt-85 -66.74 136.25 55.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.35 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -88.44 160.01 17.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.272 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -65.85 131.05 33.87 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' MET . . . . . 0.443 ' C ' ' SD ' ' A' ' 194' ' ' MET . 1.3 tmt? -148.98 120.89 8.18 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.735 0.302 . . . . 0.0 110.444 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.517 179.885 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 22.2 p30 -154.81 170.88 20.6 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.752 0.311 . . . . 0.0 110.576 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 49.29 75.09 0.16 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.596 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.9 m -69.92 144.94 52.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.528 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.0 p -158.2 162.13 37.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.583 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 44.25 88.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.654 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.6 p -74.45 162.77 28.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.616 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -74.18 144.73 44.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.72 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 32.4 tp -154.67 73.28 0.89 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.243 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.06 -40.97 93.15 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -87.02 133.44 33.58 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.794 0.33 . . . . 0.0 110.477 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.432 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 8.9 mt -143.04 -64.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.452 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -68.01 -36.41 79.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.635 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.2 -48.95 77.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.625 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.501 ' N ' ' OD1' ' A' ' 75' ' ' ASP . 17.8 p-10 -91.49 -112.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.537 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.466 ' H ' ' CG ' ' A' ' 75' ' ' ASP . 10.9 t 54.12 22.68 3.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.632 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.488 ' C ' ' H ' ' A' ' 79' ' ' GLN . 79.1 tt0 -160.09 89.01 0.84 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.363 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.6 t 70.43 -43.25 0.54 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.933 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.488 ' H ' ' C ' ' A' ' 77' ' ' GLU . 82.7 mt-30 -63.58 -37.2 86.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.372 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -60.31 -36.77 78.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.33 -49.71 75.9 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.875 0.369 . . . . 0.0 110.661 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 94.3 mt -64.54 -43.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.284 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.03 -43.27 97.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.787 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttm-85 -53.43 -53.69 47.63 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -58.0 -44.0 86.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.031 0.443 . . . . 0.0 110.632 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 93.1 mt -61.43 -50.47 80.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.563 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.09 -39.92 83.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.515 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 62.1 ttt85 -54.4 -45.71 72.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.034 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -63.31 -44.62 94.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.484 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.2 mt -64.66 -39.25 93.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.558 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.85 -44.56 74.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.117 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -64.51 -51.77 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.31 179.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -26.29 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.665 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.11 -19.79 56.64 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -62.74 -46.88 86.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.775 0.321 . . . . 0.0 110.536 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.0 m -77.41 -69.87 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.865 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.412 ' HG2' ' H ' ' A' ' 98' ' ' ASP . 3.4 ttp -76.93 -177.66 4.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.13 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.412 ' H ' ' HG2' ' A' ' 97' ' ' MET . 98.6 m-20 55.75 36.37 27.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.764 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -105.81 2.04 27.44 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.643 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m -154.81 -1.95 0.16 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.933 0.397 . . . . 0.0 110.883 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.669 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 1.4 mp -94.73 -30.19 0.28 Allowed Pre-proline 0 CA--C 1.538 0.511 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.138 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.669 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 87.9 Cg_exo -44.97 105.0 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 121.788 1.659 . . . . 0.0 112.333 -178.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.509 ' O ' ' O ' ' A' ' 102' ' ' PRO . 54.1 Cg_exo -52.54 -135.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.503 2.033 0 C-N-CA 122.433 2.088 . . . . 0.0 112.357 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.11 16.82 77.99 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.3 pp -148.49 -40.12 0.16 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.815 0.34 . . . . 0.0 110.579 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 35.7 m -64.17 -43.75 97.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.271 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -64.62 -50.56 66.68 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.966 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -63.08 -31.44 80.72 Favored Glycine 0 CA--C 1.522 0.507 0 N-CA-C 110.739 -0.945 . . . . 0.0 110.739 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.6 -48.45 81.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -47.74 84.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.443 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.22 -45.75 86.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.123 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.44 ' O ' ' OD1' ' A' ' 115' ' ' ASN . 58.1 tt0 -61.73 -35.31 77.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.031 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.2 tp -64.23 -33.42 75.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.392 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . 0.464 ' C ' ' H ' ' A' ' 116' ' ' THR . 61.3 ttp180 -60.0 -40.76 90.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.741 -179.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 116' ' ' THR . 33.1 p-10 -48.82 -13.96 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.668 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.464 ' H ' ' C ' ' A' ' 114' ' ' ARG . 99.5 m -61.42 -46.5 89.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.692 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.524 ' O ' ' N ' ' A' ' 119' ' ' SER . 29.0 p -79.27 -52.87 7.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.632 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' A' ' 117' ' ' SER . 30.9 ptt180 33.71 31.05 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.224 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.524 ' N ' ' O ' ' A' ' 117' ' ' SER . 47.1 m -122.04 -11.43 8.48 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.66 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -89.39 -10.89 44.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.911 0.386 . . . . 0.0 110.515 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -68.72 -38.75 80.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.08 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 36.3 p30 -87.42 0.08 56.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.627 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -68.11 -42.98 79.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.007 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.57 ' C ' ' H ' ' A' ' 126' ' ' ASP . 97.7 m-20 -136.01 -33.23 0.85 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.648 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.59 15.95 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.313 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.57 ' H ' ' C ' ' A' ' 124' ' ' ASN . 39.2 t70 -80.83 -76.63 0.23 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.796 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 pp -59.75 -31.66 69.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.702 0.286 . . . . 0.0 110.837 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.14 -40.35 70.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.18 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 27.0 m -60.79 -50.7 72.41 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.102 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.5 73.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.245 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.64 -46.23 89.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.137 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.28 -47.93 59.01 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.625 -0.43 . . . . 0.0 109.991 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -59.82 -43.55 94.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.671 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 5.7 tt -64.14 -41.27 97.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.978 0.418 . . . . 0.0 110.703 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -27.69 46.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -55.4 -25.24 34.58 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.023 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -115.72 -107.22 0.38 Allowed 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.524 ' OH ' ' NH1' ' A' ' 140' ' ' ARG . 76.3 t80 57.37 64.65 4.1 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.9 0.381 . . . . 0.0 110.673 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.429 ' O ' ' O ' ' A' ' 140' ' ' ARG . 62.9 Cg_endo -77.47 -50.14 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.378 2.052 . . . . 0.0 111.75 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.524 ' NH1' ' OH ' ' A' ' 138' ' ' TYR . 56.2 ttp180 55.59 162.42 0.02 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.605 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.592 ' O ' ' N ' ' A' ' 144' ' ' LYS . 45.9 t0 -47.72 -45.17 28.44 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' MET . . . . . 0.45 ' C ' ' O ' ' A' ' 141' ' ' ASP . 39.0 ttm -28.09 -48.34 0.05 Allowed 'General case' 0 N--CA 1.473 0.707 0 O-C-N 123.408 0.442 . . . . 0.0 111.143 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -66.06 -48.09 72.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.282 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . 0.592 ' N ' ' O ' ' A' ' 141' ' ' ASP . 39.3 ttmt -63.69 -36.46 83.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.143 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -71.32 -45.95 61.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.882 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -57.78 -49.45 76.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.419 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 3.5 m -64.41 -50.24 68.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.007 0.432 . . . . 0.0 110.514 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 21.8 ttp -62.13 -34.88 77.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.65 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 46.1 tp -59.67 -48.25 82.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.188 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.52 -43.96 95.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.568 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 56.7 tp -61.38 -45.88 92.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.379 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.92 73.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.405 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.4 tp -66.47 -39.39 88.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.43 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 37.6 mt -61.51 -45.83 92.55 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.466 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.95 -39.81 90.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.681 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.22 -42.19 66.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.526 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -66.72 -41.78 87.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.689 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -61.49 -45.32 94.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.575 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 69.5 t -63.42 -44.89 99.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.38 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.48 -39.23 92.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.832 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 47.0 m -164.89 164.37 20.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -122.04 134.61 54.79 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' THR . . . . . 0.475 ' OG1' ' NH2' ' A' ' 168' ' ' ARG . 0.5 OUTLIER -90.24 157.3 45.34 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 120.641 0.257 . . . . 0.0 110.541 -179.371 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 163' ' ' THR . 76.3 Cg_exo -42.19 170.05 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.411 2.074 . . . . 0.0 111.959 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 79.9 p -119.82 15.91 12.64 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.623 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 54.7 tp -127.2 -45.12 1.55 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.712 0.291 . . . . 0.0 110.645 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' A' ' 167' ' ' LEU . 10.8 mp -59.88 -39.81 86.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.05 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.504 ' O ' ' ND1' ' A' ' 172' ' ' HIS . 9.7 ptp180 -71.17 -34.44 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.608 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -62.31 -46.89 86.72 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.96 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.479 ' O ' ' OG1' ' A' ' 173' ' ' THR . 7.5 p -69.97 -33.28 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.133 0.492 . . . . 0.0 110.119 179.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -59.16 -46.28 88.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.115 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . 0.504 ' ND1' ' O ' ' A' ' 168' ' ' ARG . 72.0 m80 -65.32 -42.24 93.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' THR . . . . . 0.479 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 51.9 p -58.21 -46.09 86.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.348 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' THR . . . . . 0.467 ' N ' ' HG1' ' A' ' 173' ' ' THR . 76.8 m -59.63 -44.63 93.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.917 0.389 . . . . 0.0 110.341 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.79 -44.28 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.481 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -56.93 -40.96 77.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.334 -179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -62.31 -45.26 94.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.33 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.83 -43.51 98.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.095 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -49.54 -34.86 18.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.31 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -93.18 141.63 28.2 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 8.0 m120 59.13 41.68 20.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.507 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.87 -44.46 96.77 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.269 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -59.11 -37.58 77.52 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.209 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -60.55 -46.99 88.15 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.392 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -64.0 -35.59 81.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 190' ' ' ALA . 62.0 t -59.82 -45.62 94.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.213 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.45 -49.9 73.58 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.691 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.5 t -59.96 -41.68 92.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.442 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.491 ' CD2' ' N ' ' A' ' 189' ' ' LEU . 3.8 mm? -93.21 4.23 54.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.687 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . 0.506 ' O ' ' N ' ' A' ' 192' ' ' ASN . . . -39.58 -70.62 0.1 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.71 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 40.5 -92.35 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.728 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.506 ' N ' ' O ' ' A' ' 190' ' ' ALA . 11.3 m120 -63.04 -40.98 99.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.36 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . 0.418 ' N ' ' O ' ' A' ' 190' ' ' ALA . . . 84.22 100.63 0.6 Allowed Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 28.3 ttt -63.48 -41.51 98.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.766 0.317 . . . . 0.0 110.52 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 53.9 p-10 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.98 -1.009 . . . . 0.0 110.443 179.894 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 63.4 t-20 -85.92 108.47 18.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.814 0.34 . . . . 0.0 110.394 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -132.77 143.33 49.51 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.315 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 88.7 p -159.75 163.49 34.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.309 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.4 m -132.15 163.03 29.42 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.286 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -143.78 151.81 40.44 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.279 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.683 ' HG ' ' H ' ' A' ' 68' ' ' ARG . 27.1 t -174.71 -121.81 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.32 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.683 ' H ' ' HG ' ' A' ' 67' ' ' SER . 83.4 mtp180 55.34 -168.5 0.09 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.613 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.419 ' O ' ' O ' ' A' ' 68' ' ' ARG . 46.1 mt 59.24 149.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.291 179.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.544 ' C ' ' H ' ' A' ' 72' ' ' ILE . . . -53.57 170.1 0.96 Allowed Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -72.26 30.53 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.664 0.269 . . . . 0.0 110.848 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.544 ' H ' ' C ' ' A' ' 70' ' ' GLY . 20.8 tt -65.91 -41.18 89.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.748 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.408 ' N ' ' CG2' ' A' ' 72' ' ' ILE . 17.1 pt-20 -77.76 -8.11 57.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.535 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.416 ' O ' ' O ' ' A' ' 75' ' ' ASP . . . -65.13 -36.88 85.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.426 179.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.416 ' O ' ' O ' ' A' ' 74' ' ' ALA . 70.3 m-20 -59.21 -149.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.361 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.9 t 57.06 71.92 0.54 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.833 0.349 . . . . 0.0 110.66 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -173.04 -75.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.48 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.2 m -59.93 -40.7 89.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.392 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? 72.08 -64.61 0.38 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.311 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -65.3 -47.0 78.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.574 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -65.88 -33.96 77.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.353 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.68 -43.37 98.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.857 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.2 mt -63.44 -43.84 98.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.201 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.62 -55.49 23.2 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -53.2 -46.25 68.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.3 mm -62.15 -45.58 98.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 179.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -50.88 -35.08 31.02 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.826 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.8 mmt-85 -66.15 -50.01 65.44 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.815 0.34 . . . . 0.0 110.091 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -69.44 -50.42 45.8 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.109 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 94' ' ' GLY . 1.3 tt -53.88 -41.68 67.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.004 0.431 . . . . 0.0 109.853 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.95 -48.51 81.51 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.922 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -64.47 -51.94 60.51 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.412 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.1 p -68.62 -31.84 52.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 109.894 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -60.23 -34.25 83.64 Favored Glycine 0 CA--C 1.519 0.292 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.41 -47.56 84.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.129 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.3 m -114.01 111.78 22.21 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.132 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 79.7 mtp -85.38 -102.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 43.9 t0 50.99 18.99 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.601 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -140.58 -53.46 0.5 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.2 p -87.63 0.33 55.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.25 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.1 pt -39.72 148.56 0.3 Allowed Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.781 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -37.16 155.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.49 1.269 0 C-N-CA 122.297 1.998 . . . . 0.0 112.358 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.55 -161.6 0.08 OUTLIER 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 122.923 2.416 . . . . 0.0 111.659 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.663 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . 76.78 -169.29 54.95 Favored Glycine 0 CA--C 1.518 0.269 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.513 ' CD1' ' N ' ' A' ' 105' ' ' LEU . 6.4 mp 55.19 -0.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.751 0.31 . . . . 0.0 110.735 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.663 ' H ' ' C ' ' A' ' 104' ' ' GLY . 33.7 m -59.3 -50.4 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.913 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.414 ' N ' ' CG2' ' A' ' 106' ' ' VAL . 20.6 t-20 -57.36 -46.65 83.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.228 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.5 -42.57 95.67 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.083 -1.207 . . . . 0.0 110.083 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 tp -59.42 -40.84 88.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.78 -37.44 87.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.6 tp -61.74 -48.75 79.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.866 0.365 . . . . 0.0 111.27 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.555 ' O ' ' N ' ' A' ' 116' ' ' THR . 16.4 pt20 -71.92 -45.17 62.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.033 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.99 -25.79 65.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.3 -179.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -79.33 -49.2 12.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.54 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.53 ' C ' ' H ' ' A' ' 117' ' ' SER . 98.3 m-20 -89.35 -56.71 3.15 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.053 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.555 ' N ' ' O ' ' A' ' 112' ' ' GLN . 1.7 m -61.75 0.69 0.32 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.031 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.591 ' C ' ' H ' ' A' ' 119' ' ' SER . 4.7 p -48.06 177.13 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.218 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 71.77 -31.27 0.22 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.591 ' H ' ' C ' ' A' ' 117' ' ' SER . 43.1 m -54.68 -33.05 60.25 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.83 -178.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 119' ' ' SER . 72.1 tt0 -41.12 164.74 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.06 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 64.4 29.52 13.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.455 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.409 ' OD2' ' O ' ' A' ' 119' ' ' SER . 97.1 m-20 -127.09 3.23 6.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.341 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 66.8 mmt-85 -64.83 -45.87 84.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.656 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -67.12 -41.3 86.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.629 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.453 ' O ' ' OG1' ' A' ' 129' ' ' THR . 8.9 ttm180 -80.73 9.39 6.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.21 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -59.09 -49.26 78.57 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.03 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.31 -41.26 70.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.124 0.488 . . . . 0.0 111.175 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.77 -28.58 70.08 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.791 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.453 ' OG1' ' O ' ' A' ' 125' ' ' ARG . 96.6 m -59.67 -52.68 64.47 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.099 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.16 -47.34 74.33 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.817 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 30.5 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.379 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -53.6 -39.04 64.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.919 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -64.17 -36.55 84.41 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.562 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.64 -48.94 78.6 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.545 -178.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.439 ' CD2' ' N ' ' A' ' 135' ' ' LEU . 4.2 mm? -61.3 -29.76 70.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.435 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 -57.51 -37.63 73.32 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.279 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -106.87 64.02 0.64 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.406 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.433 ' OH ' ' SD ' ' A' ' 142' ' ' MET . 6.2 t80 -166.89 92.3 0.74 Allowed Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.339 179.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.13 145.25 54.68 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.343 2.029 . . . . 0.0 112.11 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 58.1 -169.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.363 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.457 ' C ' ' H ' ' A' ' 143' ' ' GLU . 66.4 t0 -114.27 -31.46 6.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.532 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' MET . . . . . 0.433 ' SD ' ' OH ' ' A' ' 138' ' ' TYR . 2.5 ttt 77.99 -34.17 0.18 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.559 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.457 ' H ' ' C ' ' A' ' 141' ' ' ASP . 81.3 tt0 -65.36 -35.43 80.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.599 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -63.37 -40.99 98.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.776 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.475 ' OE1' ' N ' ' A' ' 145' ' ' GLU . 57.9 mp0 -67.7 -52.45 37.59 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.794 -0.762 . . . . 0.0 109.51 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -53.15 -38.76 63.02 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.555 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 16.8 m -61.85 -43.31 99.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.511 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 50.6 mtt -62.66 -39.42 93.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.747 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.437 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.6 t -61.69 -42.3 93.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.281 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.41 -44.99 92.76 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.203 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.08 -31.5 72.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.818 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.74 -39.96 69.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.43 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 16.3 mt -60.87 -42.14 97.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.039 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.35 -49.79 74.15 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.667 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.8 -36.04 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.621 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -62.27 -45.66 92.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.583 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.13 -41.39 98.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.768 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.7 t -61.51 -46.65 96.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.485 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.41 -48.81 76.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.971 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 37.2 t -162.94 158.98 23.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.456 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -134.21 133.14 40.55 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.933 0.397 . . . . 0.0 110.429 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.12 155.0 80.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.322 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.51 -19.4 54.8 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.627 2.218 . . . . 0.0 111.867 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' SER . . . . . 0.518 ' O ' ' N ' ' A' ' 167' ' ' LEU . 7.7 t 52.13 -148.07 0.42 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.256 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 45.3 mt 59.5 -74.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.755 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 165' ' ' SER . 47.5 mt -62.6 -41.07 98.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.313 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -62.55 -43.51 98.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -63.25 -44.14 96.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.651 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.451 ' O ' ' OG1' ' A' ' 173' ' ' THR . 71.0 t -63.41 -47.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.881 0.372 . . . . 0.0 110.398 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.07 -47.0 86.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.439 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -64.26 -40.34 95.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' THR . . . . . 0.451 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 8.9 p -62.94 -43.76 97.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.607 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.7 m -61.97 -50.46 72.02 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.473 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.6 t -62.08 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.213 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -62.18 -39.74 93.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -58.81 -47.08 86.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.583 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.97 -42.82 95.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.431 . . . . 0.0 110.634 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . 0.416 ' C ' ' N ' ' A' ' 181' ' ' ASN . 11.6 m120 -49.87 -34.49 20.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.696 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -46.91 -19.48 0.1 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.91 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . 0.416 ' N ' ' C ' ' A' ' 179' ' ' ASN . 65.9 t30 -128.62 -46.4 1.3 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.094 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 53.7 tp -62.99 -36.98 85.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.505 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -51.45 -34.96 37.57 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.572 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -66.03 -50.59 63.69 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -61.83 -47.97 82.69 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.022 0.439 . . . . 0.0 111.686 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 23.0 m -66.59 -32.97 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.253 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -59.67 -48.99 79.48 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.506 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.6 t -61.41 -42.75 99.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.76 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 88.5 mt -63.57 -38.62 91.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.365 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -52.27 -29.57 23.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.522 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -71.83 133.27 45.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.851 0.358 . . . . 0.0 110.532 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 54.28 34.2 19.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.425 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . 0.433 ' O ' ' O ' ' A' ' 194' ' ' MET . . . -83.14 -173.52 49.73 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' MET . . . . . 0.433 ' O ' ' O ' ' A' ' 193' ' ' GLY . 81.4 mmm 56.17 158.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.908 0.385 . . . . 0.0 110.42 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 . . . . . 0 C--O 1.219 -0.552 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.459 -179.797 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.2 p30 -83.53 -2.69 56.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.876 0.37 . . . . 0.0 110.524 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -64.1 -39.78 94.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.524 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.0 t -102.37 123.65 46.54 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.393 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.407 ' HG ' ' N ' ' A' ' 66' ' ' HIS . 41.9 t -159.03 158.8 33.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.463 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.407 ' N ' ' HG ' ' A' ' 65' ' ' SER . 32.1 p-80 -149.25 148.8 30.0 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.544 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 85.1 p -74.63 160.07 31.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.331 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 23.9 mmt85 -92.17 129.96 38.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.048 0.451 . . . . 0.0 110.645 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.522 ' CD2' ' N ' ' A' ' 69' ' ' LEU . 3.7 mm? -81.57 148.39 29.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.433 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -38.89 -88.32 0.01 OUTLIER Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.8 ttt-85 -155.81 97.83 1.86 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.866 0.365 . . . . 0.0 110.394 179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.621 ' C ' ' H ' ' A' ' 74' ' ' ALA . 19.8 pt -137.23 171.74 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.162 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 61.05 -7.78 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.82 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.621 ' H ' ' C ' ' A' ' 72' ' ' ILE . . . -66.63 -35.48 80.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.555 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.6 p30 -92.1 13.87 17.64 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.572 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 94.7 p -55.67 -24.52 34.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.635 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.442 ' OE1' ' O ' ' A' ' 74' ' ' ALA . 57.7 mp0 -61.52 -36.22 79.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.28 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.3 m -122.78 113.36 19.08 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.067 0.461 . . . . 0.0 110.185 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -65.33 -34.16 77.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.67 -33.74 76.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -61.91 -35.6 78.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.068 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 95.6 mt -62.48 -45.42 98.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.216 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.99 -41.55 89.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.241 0.543 . . . . 0.0 110.388 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -69.12 -44.62 72.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.435 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -61.12 -56.18 23.88 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.035 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.419 ' CG2' ' N ' ' A' ' 87' ' ' ALA . 18.8 tt -61.47 -41.19 89.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.441 0.639 . . . . 0.0 109.756 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.419 ' N ' ' CG2' ' A' ' 86' ' ' ILE . . . -51.02 -40.21 57.67 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -68.58 -44.38 74.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.34 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -62.83 -50.34 71.34 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.8 mt -52.13 -39.82 60.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.126 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.96 -49.04 79.07 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.857 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.74 -50.77 55.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.284 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 87.3 t -60.23 -42.32 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.193 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -53.96 -43.42 71.8 Favored Glycine 0 CA--C 1.519 0.335 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -76.2 -47.16 25.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.542 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.551 ' C ' ' H ' ' A' ' 98' ' ' ASP . 18.3 m -61.16 -71.8 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.532 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 73.7 mmm 66.07 -41.65 0.36 Allowed 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.693 0.621 . . . . 0.0 110.656 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.551 ' H ' ' C ' ' A' ' 96' ' ' SER . 68.2 t0 -61.88 -40.07 94.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.489 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -64.66 -43.36 93.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.401 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.453 ' O ' ' C ' ' A' ' 101' ' ' ILE . 51.5 m -80.39 -127.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.381 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.453 ' C ' ' O ' ' A' ' 100' ' ' SER . 1.0 OUTLIER -28.65 93.46 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.467 0 O-C-N 123.616 0.573 . . . . 0.0 111.005 -179.872 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.433 ' N ' ' O ' ' A' ' 100' ' ' SER . 52.4 Cg_exo -48.99 166.66 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.244 1.962 . . . . 0.0 112.399 -178.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.511 ' C ' ' H ' ' A' ' 105' ' ' LEU . 51.8 Cg_exo -53.74 146.59 44.18 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.335 2.023 . . . . 0.0 111.866 178.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.57 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . -69.19 43.65 0.41 Allowed Glycine 0 CA--C 1.521 0.461 0 N-CA-C 110.801 -0.92 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.511 ' H ' ' C ' ' A' ' 103' ' ' PRO . 3.7 mm? 58.55 -2.18 0.09 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.57 ' H ' ' C ' ' A' ' 104' ' ' GLY . 13.8 p -70.77 -35.06 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.563 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -61.12 -40.84 95.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.509 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.13 -51.18 58.56 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 60.4 tp -62.86 -42.6 99.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.543 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.4 -48.48 81.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 tp -64.82 -45.06 87.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.742 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -67.77 -26.9 66.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.667 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.433 ' O ' ' OG1' ' A' ' 116' ' ' THR . 57.1 tp -61.51 -43.0 99.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.135 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -59.79 -34.11 72.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.836 0.351 . . . . 0.0 110.369 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -58.74 -40.37 83.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.224 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 113' ' ' LEU . 45.5 p -72.58 -20.7 61.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.489 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 52.4 p -89.78 7.55 36.34 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.474 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -59.87 -42.39 93.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.475 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.5 m -62.0 146.4 50.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.519 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 52.72 76.99 0.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.416 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.591 ' C ' ' H ' ' A' ' 123' ' ' ARG . 97.4 mt-10 -78.68 -174.49 3.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.375 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.401 ' OD1' ' OD2' ' A' ' 126' ' ' ASP . 36.1 t70 56.8 -0.0 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.529 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.591 ' H ' ' C ' ' A' ' 121' ' ' GLU . 79.8 ttt180 -63.33 -44.47 94.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.526 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.548 ' O ' ' N ' ' A' ' 126' ' ' ASP . 11.0 m120 -126.49 -72.47 0.65 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -52.73 84.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.239 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.548 ' N ' ' O ' ' A' ' 124' ' ' ASN . 26.1 t0 -163.84 -93.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.046 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 31.8 mt -52.8 -38.24 60.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.535 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.12 -47.84 71.4 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 81.8 m -62.36 -43.75 98.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.861 0.362 . . . . 0.0 110.455 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.96 -47.5 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.537 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -61.57 -42.43 98.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.404 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -64.03 -52.71 58.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.058 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -61.33 -44.62 96.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.683 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.31 -51.12 65.05 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.4 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 41.4 tp -57.72 -38.89 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.302 -178.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -56.69 -26.38 56.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.591 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -114.81 -130.64 0.31 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.004 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.572 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 46.5 t80 56.02 54.21 8.57 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 121.049 0.452 . . . . 0.0 110.677 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.437 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 57.0 Cg_endo -72.35 -13.75 28.05 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.557 2.172 . . . . 0.0 111.809 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -65.95 157.25 31.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.61 -179.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 56.12 29.22 14.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.614 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 50.1 mtt -149.77 -104.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.642 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -67.25 -32.66 73.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.598 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -58.38 -43.34 88.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.667 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -66.49 -51.87 52.11 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -52.69 -40.9 63.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.313 -179.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.5 m -59.83 -51.49 69.5 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.758 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 78.0 mtm -68.66 -40.0 80.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.017 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 62.9 mt -63.61 -43.18 97.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.691 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 40.9 t -60.78 -44.73 98.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.217 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 54.4 tp -61.02 -46.74 89.51 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.51 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.43 -35.91 81.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.5 tp -70.28 -35.68 73.9 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.929 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -45.96 92.47 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.868 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.32 -46.06 91.84 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.313 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.2 -45.18 74.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.535 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -64.25 -36.54 84.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.339 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.29 -47.17 86.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.276 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 96.0 t -64.93 -45.26 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.708 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -57.36 -48.55 78.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.26 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.506 ' C ' ' CG ' ' A' ' 162' ' ' HIS . 97.9 p -110.13 -133.11 0.33 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.559 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.506 ' CG ' ' C ' ' A' ' 161' ' ' SER . 0.1 OUTLIER -179.99 165.78 1.23 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.974 0.416 . . . . 0.0 109.953 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 4.6 p -73.02 149.76 89.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.65 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.68 -88.27 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.528 2.152 . . . . 0.0 112.307 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' SER . . . . . 0.49 ' O ' ' NE ' ' A' ' 168' ' ' ARG . 15.7 t -170.77 -121.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.607 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 36.7 mt -80.97 -6.66 59.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.497 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 50.4 mt -62.23 -33.33 74.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.372 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.497 ' CG ' ' N ' ' A' ' 169' ' ' ASP . 14.8 ptp180 -60.95 -45.61 94.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.519 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . 0.497 ' N ' ' CG ' ' A' ' 168' ' ' ARG . 67.1 t0 -65.26 -40.76 94.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.68 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.9 t -61.37 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.305 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -57.09 -47.29 81.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.46 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . 0.663 ' CD2' HD22 ' A' ' 176' ' ' ASN . 73.5 t60 -61.55 -37.02 82.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.22 0.533 . . . . 0.0 110.142 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 79.4 m -65.78 -43.23 89.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.764 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 96.3 m -58.44 -52.36 65.95 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.939 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.4 p -60.66 -38.17 77.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.06 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . 0.663 HD22 ' CD2' ' A' ' 172' ' ' HIS . 92.5 m-20 -61.89 -41.07 97.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -60.09 -46.55 89.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.399 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 53.2 mt -65.26 -43.24 95.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.01 179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -51.11 -34.75 32.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.738 -179.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . 0.53 ' NE2' ' O ' ' A' ' 176' ' ' ASN . 0.6 OUTLIER -67.46 -15.24 63.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.638 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . 0.423 ' OD1' ' O ' ' A' ' 180' ' ' GLN . 99.7 m-20 -142.86 35.89 1.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.67 0.271 . . . . 0.0 110.372 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -44.37 97.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.077 0.465 . . . . 0.0 110.502 -178.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -57.18 -46.71 82.58 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.21 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 15.3 m -57.23 -43.3 82.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.328 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -66.05 -34.18 77.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.007 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 43.7 t -59.91 -48.55 87.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.559 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -62.28 -52.73 62.55 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.147 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 96.5 p -57.99 -22.05 47.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.767 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.03 -46.8 89.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.352 -179.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -96.17 146.53 24.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.521 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -64.38 -36.58 84.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.46 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -89.41 105.25 17.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.607 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -66.06 -41.46 95.1 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 12.2 ttt -146.1 151.15 37.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.832 0.349 . . . . 0.0 110.571 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.521 179.818 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.418 -1.473 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -76.4 143.92 40.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.881 0.372 . . . . 0.0 110.812 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -94.8 128.12 41.3 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.406 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.499 ' O ' ' N ' ' A' ' 66' ' ' HIS . 34.9 t -152.88 137.14 16.56 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.822 0.344 . . . . 0.0 110.855 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.7 p 45.34 15.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.295 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.499 ' N ' ' O ' ' A' ' 64' ' ' SER . 29.9 m170 -87.97 -14.98 37.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.522 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 78.2 p -61.88 -34.99 77.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.41 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 78.0 ttt-85 -102.22 100.78 11.01 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.031 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 67.7 mt 41.06 65.17 0.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.478 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.08 -67.62 1.93 Allowed Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.0 ttp85 -94.24 101.33 13.3 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.559 ' O ' ' N ' ' A' ' 74' ' ' ALA . 96.3 mt -93.66 111.03 24.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 53.09 -81.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.559 ' N ' ' O ' ' A' ' 72' ' ' ILE . . . -178.56 -3.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.411 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -84.75 1.59 45.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.97 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 90.7 p -58.75 -42.85 89.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.802 0.334 . . . . 0.0 110.54 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -71.98 -35.04 69.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.642 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.0 m -85.64 20.52 2.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.361 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -52.3 -29.63 24.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.588 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.26 -38.98 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.44 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.06 -43.54 98.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.424 HG21 HD11 ' A' ' 82' ' ' ILE . 87.9 mt -63.02 -43.16 98.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.615 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.1 mt -61.34 -42.4 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -54.01 -54.69 35.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -54.79 -40.17 69.19 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.687 0.279 . . . . 0.0 110.427 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.0 mm -64.49 -46.36 92.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.323 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.7 90.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.649 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -59.4 -48.96 79.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.823 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -66.79 -40.54 88.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.089 0.471 . . . . 0.0 110.118 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.542 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.2 tt -67.24 -37.43 83.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.511 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.59 -47.8 83.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.75 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -64.74 -52.17 58.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.554 -0.459 . . . . 0.0 110.153 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.88 -26.74 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.578 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -76.14 -31.28 55.61 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -61.76 -46.98 87.24 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p -66.48 -32.05 73.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.554 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 60.8 ttp -61.35 -36.18 79.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.388 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.54 -17.22 59.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.939 0.4 . . . . 0.0 110.314 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -59.38 -44.92 92.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.072 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t -123.02 115.18 21.45 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.139 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.43 ' O ' ' CG2' ' A' ' 101' ' ' ILE . 16.5 tt -171.13 79.52 0.53 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.623 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.488 ' O ' ' N ' ' A' ' 104' ' ' GLY . 23.3 Cg_exo -62.82 156.35 54.27 Favored 'Trans proline' 0 C--N 1.302 -1.904 0 C-N-CA 122.532 2.155 . . . . 0.0 112.197 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.535 ' O ' ' N ' ' A' ' 105' ' ' LEU . 37.0 Cg_exo -42.45 -18.31 0.09 OUTLIER 'Trans proline' 0 C--N 1.311 -1.447 0 C-N-CA 122.752 2.301 . . . . 0.0 111.738 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 102' ' ' PRO . . . 59.55 -75.67 0.01 OUTLIER Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.042 -0.823 . . . . 0.0 111.042 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.535 ' N ' ' O ' ' A' ' 103' ' ' PRO . 1.8 pt? -179.24 -25.19 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.905 0.383 . . . . 0.0 110.825 -178.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 66.2 t -58.93 -46.13 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.403 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -59.87 -45.05 93.72 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.087 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -77.15 -22.66 70.54 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.457 ' N ' ' O ' ' A' ' 105' ' ' LEU . 53.4 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.325 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.04 -48.07 77.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.322 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.76 -43.36 93.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.428 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -44.86 75.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.258 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 tp -63.51 -44.64 93.7 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.388 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -51.37 -38.28 52.5 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.86 -51.55 54.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.046 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 21.0 m -66.83 -47.29 72.47 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.311 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.1 m -54.44 98.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.473 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.8 mtp85 -137.45 -121.53 0.14 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.291 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 46.5 m -59.62 -38.68 81.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.422 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -65.32 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.829 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 57.57 41.67 25.35 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.441 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -152.18 -9.87 0.19 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.536 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -82.45 -80.21 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.256 -179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -64.2 -41.48 97.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.072 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.49 54.69 0.76 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.043 0.449 . . . . 0.0 110.313 -179.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -130.97 -75.07 0.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.427 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.0 -33.5 75.87 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.55 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -44.15 71.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.087 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.8 m -60.33 -51.41 69.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.19 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.27 -46.39 80.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.159 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 36.7 tp -61.58 -43.35 99.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.567 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -62.41 -51.56 67.05 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.387 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mm-40 -60.87 -39.86 90.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.141 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.2 tp -61.55 -51.39 68.76 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.781 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.64 -38.13 80.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.299 0.571 . . . . 0.0 110.44 -177.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -56.43 -25.6 50.85 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.312 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -156.07 98.05 1.85 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.566 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.575 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 6.7 p90 -141.43 68.49 26.06 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-O 121.526 0.679 . . . . 0.0 110.352 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -51.9 -37.61 67.02 Favored 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 122.462 2.108 . . . . 0.0 112.439 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.432 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 74.9 mtp180 42.62 -112.28 0.2 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.62 -179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 140' ' ' ARG . 97.7 m-20 -141.93 106.3 4.82 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.542 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 10.7 ptm -154.84 -34.94 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.604 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -64.41 -37.89 89.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 0.0 110.141 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -64.15 -46.01 85.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.033 0.444 . . . . 0.0 110.066 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -55.28 -30.16 59.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.64 -178.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -69.13 -43.73 73.78 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.214 178.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.429 ' O ' ' CB ' ' A' ' 151' ' ' LEU . 84.2 m -69.96 -36.02 74.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.537 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.4 mtt -60.27 -46.03 91.23 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.02 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.3 mp -73.25 -50.6 21.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.43 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 79.1 t -60.56 -45.74 96.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.498 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.429 ' CB ' ' O ' ' A' ' 147' ' ' THR . 56.6 tp -58.05 -44.72 87.58 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.496 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.87 -36.7 82.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.48 ' CG ' ' HZ1' ' A' ' 157' ' ' LYS . 38.5 tp -63.67 -42.05 98.11 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.912 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.34 -42.42 95.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.414 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.22 -40.24 96.9 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.75 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.16 -39.02 69.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.269 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.48 ' HZ1' ' CG ' ' A' ' 153' ' ' LEU . 31.2 mttp -62.73 -44.68 95.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.834 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.7 -44.21 97.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.457 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 80.7 t -65.48 -43.06 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.085 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.442 ' C ' ' HG ' ' A' ' 161' ' ' SER . . . -60.15 -47.63 85.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.81 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.442 ' HG ' ' C ' ' A' ' 160' ' ' ALA . 74.5 m -167.89 168.12 12.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.39 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -117.92 127.04 53.47 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.989 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.46 156.91 59.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.643 -179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -69.67 157.59 60.04 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.954 2.436 . . . . 0.0 112.537 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 54.8 m -83.18 -33.39 26.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.056 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 73.2 mt -60.64 -53.46 57.24 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 110.754 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.19 -41.79 98.67 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -59.08 -43.32 91.77 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.221 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.98 -43.28 99.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.677 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.452 ' O ' ' OG1' ' A' ' 173' ' ' THR . 96.4 t -62.88 -43.34 98.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.066 0.46 . . . . 0.0 110.221 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -56.29 -49.24 74.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -61.86 -45.35 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.544 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 19.4 p -58.37 -45.69 87.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.195 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -54.04 -45.71 71.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 110.272 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 86.0 t -61.13 -44.42 98.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.782 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -60.93 -39.56 89.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.499 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -59.46 -42.46 92.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.492 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 96.6 mt -61.99 -41.45 91.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.683 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -59.35 -34.54 72.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.6 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -65.8 -48.44 71.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.979 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -106.68 48.56 0.83 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.95 0.405 . . . . 0.0 110.371 -179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp -63.95 -41.19 97.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.824 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -60.11 -45.59 92.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.245 0.545 . . . . 0.0 110.021 -179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -57.18 -44.62 83.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.809 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -58.17 -39.7 79.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.58 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.5 t -58.43 -50.2 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.035 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -68.47 -45.84 71.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.299 0.571 . . . . 0.0 110.745 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 23.6 p -58.64 -35.07 71.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.998 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.439 ' O ' ' CB ' ' A' ' 190' ' ' ALA . 85.3 mt -99.37 30.06 3.7 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.266 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . 0.439 ' CB ' ' O ' ' A' ' 189' ' ' LEU . . . 80.23 116.04 0.06 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.037 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 8.8 tmm_? -76.11 135.05 39.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.874 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.42 ' OD1' ' O ' ' A' ' 192' ' ' ASN . 46.1 p-10 -103.55 134.94 46.07 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.761 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -158.74 26.78 0.4 Allowed Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 95.9 mtp 45.59 41.7 7.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.812 0.339 . . . . 0.0 110.574 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 . . . . . 0 C--O 1.221 -0.429 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.695 179.994 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -140.63 115.46 9.65 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.814 0.34 . . . . 0.0 110.526 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -148.27 171.25 16.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.56 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.423 ' O ' ' OG ' ' A' ' 65' ' ' SER . 87.9 p 48.86 -96.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.803 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.425 ' O ' ' OG ' ' A' ' 65' ' ' SER . 24.3 p 58.41 95.71 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.532 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -75.84 137.14 40.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.323 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.7 t -164.49 40.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.894 0.378 . . . . 0.0 110.597 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -63.64 -38.14 89.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.781 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.471 ' CD2' ' H ' ' A' ' 69' ' ' LEU . 0.1 OUTLIER -74.22 146.82 43.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.021 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' A' ' 69' ' ' LEU . . . -60.56 -140.99 0.01 OUTLIER Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.432 ' O ' ' O ' ' A' ' 72' ' ' ILE . 94.0 mtm-85 -92.4 9.47 34.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.771 0.32 . . . . 0.0 110.283 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.697 ' C ' ' H ' ' A' ' 74' ' ' ALA . 4.0 mm -60.59 -140.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.915 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.451 ' H ' ' CG2' ' A' ' 72' ' ' ILE . 81.2 tt0 62.35 -24.26 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.827 -179.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.697 ' H ' ' C ' ' A' ' 72' ' ' ILE . . . -60.27 -156.88 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 110.32 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 49.79 20.34 0.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.452 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.2 p -61.48 -24.63 66.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.393 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -62.63 -39.35 93.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.538 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.1 m -109.75 94.91 5.27 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.916 0.389 . . . . 0.0 110.498 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -60.66 -31.52 70.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.952 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -66.89 -36.61 82.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.449 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -61.52 -45.27 94.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.158 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.427 HG22 HD13 ' A' ' 82' ' ' ILE . 96.6 mt -65.08 -44.38 95.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.354 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 97.2 mt -66.07 -41.11 88.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.253 0.549 . . . . 0.0 110.27 179.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -70.61 -50.31 38.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.851 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -52.91 -55.09 25.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.303 -178.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.449 ' CG2' ' N ' ' A' ' 87' ' ' ALA . 21.0 tt -63.29 -44.61 99.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.724 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.449 ' N ' ' CG2' ' A' ' 86' ' ' ILE . . . -51.13 -39.38 56.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.955 -178.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -65.26 -49.79 68.26 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.411 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -66.94 -52.15 46.47 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 120.337 -0.545 . . . . 0.0 109.896 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.6 tt -52.84 -38.48 61.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.114 -179.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.67 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.748 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -67.76 -46.01 73.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.854 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 96' ' ' SER . 69.3 t -66.23 -40.38 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.195 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -55.78 -42.91 86.7 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -61.69 -47.48 85.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.199 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 93' ' ' VAL . 46.7 t -109.07 110.8 22.15 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.075 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.435 ' O ' ' O ' ' A' ' 98' ' ' ASP . 10.8 ttm -64.95 -11.34 37.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.924 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.488 ' O ' ' N ' ' A' ' 100' ' ' SER . 98.8 m-20 -53.29 -167.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 51.5 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.154 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 98' ' ' ASP . 48.1 t -77.56 82.74 3.98 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.44 ' O ' ' CG2' ' A' ' 101' ' ' ILE . 15.3 tt -119.82 83.9 30.46 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.521 ' N ' ' CD ' ' A' ' 103' ' ' PRO . 23.4 Cg_exo -53.73 -40.61 79.23 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 122.006 1.804 . . . . 0.0 111.71 178.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 102' ' ' PRO . 64.4 Cg_endo -81.39 -168.49 0.63 Allowed 'Trans proline' 0 N--CA 1.488 1.159 0 C-N-CA 122.121 1.881 . . . . 0.0 112.247 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.96 4.45 90.0 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 77.7 mt -63.28 -42.62 99.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.735 0.302 . . . . 0.0 110.978 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -34.56 62.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.066 0.46 . . . . 0.0 110.467 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.33 -41.6 98.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.174 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.83 -42.24 59.42 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 3.1 tt -60.75 -48.45 81.73 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.994 0.426 . . . . 0.0 110.041 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.78 93.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.526 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.9 tt -63.31 -47.56 81.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.943 0.401 . . . . 0.0 110.165 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.86 -39.71 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.307 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.23 -42.31 99.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.402 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -64.8 -38.08 89.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.17 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.13 -37.97 75.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.155 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 20.2 m -60.69 -44.68 96.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.497 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t -96.32 79.27 3.11 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.975 0.417 . . . . 0.0 110.175 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -64.04 -39.95 95.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.644 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.9 m -54.7 -40.07 68.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.652 -179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -76.1 55.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.453 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -173.02 -53.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.471 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 122' ' ' ASP . 67.8 t0 -53.87 -31.93 51.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.19 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -54.51 -77.02 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.565 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.463 ' O ' ' N ' ' A' ' 126' ' ' ASP . 80.8 m-20 -63.3 -40.61 97.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.318 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -65.16 73.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.486 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' A' ' 124' ' ' ASN . 64.2 t0 -146.64 -90.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.148 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 60.2 mt -52.01 -33.13 37.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.672 0.272 . . . . 0.0 110.577 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.41 -49.62 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.817 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 15.5 m -62.95 -42.72 99.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.334 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.46 -46.92 80.13 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.0 mt -58.93 -41.26 86.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -54.94 -52.43 63.02 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.707 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -51.98 -47.91 64.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.107 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.423 ' O ' ' O ' ' A' ' 137' ' ' ALA . 0.2 OUTLIER -64.1 -42.89 96.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.63 -47.69 79.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.036 -178.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -56.48 -29.78 62.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.214 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . 0.423 ' O ' ' O ' ' A' ' 134' ' ' LEU . . . -107.79 97.7 7.38 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.408 ' C ' ' O ' ' A' ' 137' ' ' ALA . 2.0 t80 -38.21 131.96 0.98 Allowed Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.998 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -44.94 -46.69 12.75 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.035 1.823 . . . . 0.0 112.246 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.415 ' O ' ' CB ' ' A' ' 141' ' ' ASP . 97.1 mtt180 -45.47 -91.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.681 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.541 ' C ' ' H ' ' A' ' 143' ' ' GLU . 2.0 t70 75.08 7.01 4.23 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.083 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.7 26.1 0.07 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.01 0.433 . . . . 0.0 110.041 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.541 ' H ' ' C ' ' A' ' 141' ' ' ASP . 82.2 tt0 -66.84 -40.96 88.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.479 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -60.84 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.199 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.429 ' CG ' ' H ' ' A' ' 146' ' ' LYS . 9.7 pt-20 -72.59 -52.52 15.15 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.992 -0.683 . . . . 0.0 109.289 179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . 0.429 ' H ' ' CG ' ' A' ' 145' ' ' GLU . 64.6 tttp -52.36 -39.7 61.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.236 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.462 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 70.6 m -63.64 -44.17 94.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.617 178.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 18.9 mtm -62.89 -38.75 92.14 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.577 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.12 -41.79 99.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.076 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 75.8 t -63.39 -42.54 96.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.623 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.82 -45.26 90.38 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.195 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.41 -31.56 72.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.306 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 10.1 tp -71.98 -41.32 67.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.896 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.994 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.46 -44.09 95.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.17 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.8 -40.67 79.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.016 0.436 . . . . 0.0 110.312 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -64.2 -42.72 96.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.045 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.29 -45.12 94.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.308 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 70.5 t -62.29 -45.81 97.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.16 -41.43 97.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.767 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 28.8 t -142.97 145.14 32.69 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.366 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 35.8 m80 -68.64 -139.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.479 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 5.3 p -140.05 150.57 62.51 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.081 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.448 ' O ' ' OG ' ' A' ' 165' ' ' SER . 44.2 Cg_exo -41.96 -64.58 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 122.232 1.955 . . . . 0.0 112.565 179.557 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' SER . . . . . 0.502 ' C ' ' H ' ' A' ' 167' ' ' LEU . 1.5 m 165.48 -167.82 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.311 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.05 4.13 0.96 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.407 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.502 ' H ' ' C ' ' A' ' 165' ' ' SER . 58.0 mt -61.36 -31.7 71.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.262 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -65.06 -42.48 94.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 0.0 110.626 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -64.87 -43.84 91.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.658 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.9 t -61.19 -45.65 98.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.097 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -57.29 -42.91 82.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.097 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -59.78 -40.57 88.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.605 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 20.1 m -59.84 -44.89 93.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -59.36 -45.93 90.04 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 110.639 -179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.09 -44.53 95.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.146 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -61.9 -38.84 89.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.541 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . 0.562 ' CE2' ' CD2' ' A' ' 182' ' ' LEU . 86.1 t80 -57.21 -47.94 80.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.354 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.599 ' O ' ' N ' ' A' ' 183' ' ' ARG . 63.2 mt -64.9 -42.3 94.46 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.327 0 CA-C-O 121.053 0.454 . . . . 0.0 110.04 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . 0.539 ' O ' ' N ' ' A' ' 181' ' ' ASN . 60.3 t-20 -59.26 -34.07 71.81 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.789 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . 0.597 ' C ' ' H ' ' A' ' 182' ' ' LEU . 48.2 tt0 -59.08 70.84 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.634 -179.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 179' ' ' ASN . 6.3 m120 62.5 -20.35 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . 0.597 ' H ' ' C ' ' A' ' 180' ' ' GLN . 9.3 mp -63.3 -37.3 86.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.804 0.335 . . . . 0.0 110.175 179.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . 0.599 ' N ' ' O ' ' A' ' 178' ' ' ILE . 41.5 ttm180 -57.36 -36.88 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.5 m -59.69 -51.03 71.51 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.733 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -66.83 -39.86 87.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.113 0.482 . . . . 0.0 110.691 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.24 -39.65 83.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.332 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -61.23 -44.62 96.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.644 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 72.3 m -58.49 -38.31 77.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.361 . . . . 0.0 110.391 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 57.3 tp -70.46 98.72 1.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.204 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 193' ' ' GLY . . . -172.66 -35.43 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.634 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -64.88 -42.09 95.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.762 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 44.4 t30 -61.9 -40.22 94.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.863 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . 0.424 ' O ' ' O ' ' A' ' 190' ' ' ALA . . . -151.99 158.44 27.79 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 8.7 ptp -149.14 160.02 43.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 110.368 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.596 179.854 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.41 ' O ' ' OG ' ' A' ' 65' ' ' SER . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.424 ' O ' ' OG ' ' A' ' 65' ' ' SER . 98.2 m-20 -62.25 -41.19 98.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.813 0.34 . . . . 0.0 110.634 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 80.5 mtp85 -78.55 147.57 33.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.5 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.5 m 52.4 27.24 4.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.682 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 67.7 m -59.95 -39.31 85.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.46 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 62.0 m80 48.79 26.1 1.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.573 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 79.3 p -56.52 -32.16 64.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.286 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -78.47 140.93 38.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.284 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.504 ' C ' ' H ' ' A' ' 71' ' ' ARG . 9.8 mp -76.51 142.94 40.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.526 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.29 38.1 0.82 Allowed Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.504 ' H ' ' C ' ' A' ' 69' ' ' LEU . 22.9 mmt85 51.96 63.18 2.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.971 0.415 . . . . 0.0 110.422 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.45 ' C ' ' H ' ' A' ' 74' ' ' ALA . 17.8 tt -66.11 -33.13 61.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.417 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.452 ' O ' ' O ' ' A' ' 74' ' ' ALA . 96.9 mt-10 -54.11 -10.21 0.33 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.493 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.555 ' O ' ' N ' ' A' ' 76' ' ' SER . . . -59.17 -129.48 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.546 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 54.74 -80.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.498 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.555 ' N ' ' O ' ' A' ' 74' ' ' ALA . 27.3 t -44.98 99.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.601 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 48.25 24.64 0.71 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.552 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 56.2 p 40.78 36.36 0.4 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.683 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -47.37 -29.94 2.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.555 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -67.2 -33.87 76.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.689 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -55.72 -46.79 77.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.522 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.472 ' CD1' ' N ' ' A' ' 82' ' ' ILE . 2.0 mp -62.79 -46.04 97.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.357 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.414 HG21 HD13 ' A' ' 83' ' ' ILE . 97.2 mt -62.11 -43.04 97.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.684 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.3 ttt85 -50.97 -49.96 59.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.643 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -56.46 -43.85 79.95 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.632 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.89 -50.1 81.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.456 -0.497 . . . . 0.0 109.722 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.1 89.85 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -57.8 -48.5 79.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.67 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -66.75 -40.42 88.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.158 0.504 . . . . 0.0 110.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.526 ' O ' ' N ' ' A' ' 94' ' ' GLY . 5.9 tt -66.91 -38.87 87.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.625 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.464 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -59.97 -42.02 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.628 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -65.41 -52.51 52.82 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.921 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.5 t -69.66 -26.08 29.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.815 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.526 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -85.5 -37.36 9.71 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.224 -0.75 . . . . 0.0 111.224 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' A' ' 91' ' ' ALA . 42.7 t0 -72.05 -46.46 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.614 0.245 . . . . 0.0 110.941 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.483 ' C ' ' H ' ' A' ' 98' ' ' ASP . 70.9 m -57.62 -123.22 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.917 0.389 . . . . 0.0 111.034 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.6 ttt 62.66 1.44 0.79 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.035 0.445 . . . . 0.0 110.251 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.483 ' H ' ' C ' ' A' ' 96' ' ' SER . 43.5 t0 -62.74 -37.59 87.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.512 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -66.98 135.48 53.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.537 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 t 44.4 89.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.472 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.475 ' O ' ' CG2' ' A' ' 101' ' ' ILE . 9.3 tp -159.69 66.17 2.71 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.168 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.517 ' N ' ' CD ' ' A' ' 103' ' ' PRO . 31.9 Cg_exo -49.1 -39.8 41.51 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 121.936 1.758 . . . . 0.0 111.998 178.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.517 ' CD ' ' N ' ' A' ' 102' ' ' PRO . 31.7 Cg_exo -59.18 -158.28 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 122.222 1.948 . . . . 0.0 112.183 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.71 -2.69 84.69 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.453 ' CD1' ' N ' ' A' ' 105' ' ' LEU . 9.9 mp -89.31 -11.53 43.15 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.909 0.385 . . . . 0.0 110.296 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.36 -32.75 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.735 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.423 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 56.5 t-20 -60.32 -30.19 69.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.14 0.495 . . . . 0.0 110.518 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -64.42 -47.72 81.38 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.504 ' N ' ' CD2' ' A' ' 109' ' ' LEU . 3.5 mm? -62.91 -38.52 91.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.719 0.295 . . . . 0.0 110.708 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.99 73.31 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.236 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.6 tt -70.63 -48.09 56.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -61.79 -25.49 67.51 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.689 -179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.41 ' N ' ' O ' ' A' ' 109' ' ' LEU . 58.6 tp -60.22 -43.11 96.27 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.17 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.59 -42.64 98.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.576 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -65.46 -43.37 90.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.686 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.9 m -64.23 -46.98 81.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.66 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 3.7 m -88.67 57.12 4.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.488 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -61.25 -38.71 87.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.485 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.1 m -80.92 -96.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.429 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 40.65 77.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.592 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -167.52 -178.27 3.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.636 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 55.96 33.94 22.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.644 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -136.38 -40.54 0.65 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.557 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -153.41 12.17 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.696 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -105.63 -34.78 7.63 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.433 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -45.65 -85.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.688 -179.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.3 pp -50.76 -32.22 19.13 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.983 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.76 -48.24 69.91 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.972 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 8.4 m -60.2 -38.6 83.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.085 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -47.55 78.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.15 -44.43 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.479 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.86 -51.03 68.6 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.891 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -54.82 -37.88 66.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.598 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.8 tp -60.04 -51.14 70.92 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.28 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.11 -44.22 97.68 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.3 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -58.46 -37.63 75.85 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 138' ' ' TYR . . . -66.73 -76.35 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.321 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.43 ' C ' ' O ' ' A' ' 137' ' ' ALA . 55.9 t80 -32.7 99.5 0.15 Allowed Pre-proline 0 CA--C 1.54 0.565 0 O-C-N 123.147 0.279 . . . . 0.0 111.054 -179.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.406 ' C ' ' H ' ' A' ' 141' ' ' ASP . 73.5 Cg_endo -79.75 168.44 19.4 Favored 'Trans proline' 0 C--N 1.313 -1.291 0 C-N-CA 122.127 1.885 . . . . 0.0 111.975 -179.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.485 ' H ' ' HD3' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -82.49 35.02 0.44 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.309 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.406 ' H ' ' C ' ' A' ' 139' ' ' PRO . 52.9 t0 -81.37 90.41 6.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.3 mtt -98.67 16.14 22.98 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.412 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -59.99 -42.52 94.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.415 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.31 -33.54 73.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.654 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -70.2 -44.2 69.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.375 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -66.5 -39.46 88.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.736 179.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 72.5 m -59.7 -43.3 94.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.444 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 49.2 mtt -61.15 -45.97 92.45 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.152 -179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.33 -50.36 33.16 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.516 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 71.0 t -58.73 -43.41 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.095 -179.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.37 -45.92 90.11 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.48 82.39 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.916 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.61 -39.93 77.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.452 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.41 -41.72 90.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.61 -44.61 95.87 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.017 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.78 78.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.998 0.428 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 161' ' ' SER . 0.9 OUTLIER -60.27 -45.71 92.36 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.858 -179.244 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.55 -37.71 87.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.588 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 97.2 t -69.11 -51.72 40.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.692 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -72.53 -50.54 25.01 Favored 'General case' 0 C--O 1.218 -0.578 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.184 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.502 ' N ' ' O ' ' A' ' 157' ' ' LYS . 78.2 p 24.18 35.02 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.171 0.51 . . . . 0.0 111.165 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.692 ' N ' ' O ' ' A' ' 160' ' ' ALA . 5.7 p80 -155.98 137.99 14.52 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.389 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.1 m -162.62 128.22 2.22 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.22 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -44.16 -31.38 4.08 Favored 'Trans proline' 0 N--CA 1.49 1.306 0 C-N-CA 121.85 1.7 . . . . 0.0 112.409 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 167' ' ' LEU . 1.1 m 73.66 -158.56 0.08 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 38.7 mt 65.29 -59.28 0.27 Allowed 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.654 0.596 . . . . 0.0 110.389 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.482 ' N ' ' O ' ' A' ' 165' ' ' SER . 85.5 mt -63.96 -31.71 72.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.234 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.43 -42.04 79.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.046 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -60.7 -47.09 87.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.081 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 27.8 m -70.71 -40.04 76.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.657 179.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -58.53 -45.41 88.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.52 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -47.13 79.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.665 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.88 -39.9 91.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.611 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 71.2 m -60.41 -44.6 95.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.876 0.369 . . . . 0.0 110.443 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 73.0 t -63.72 -40.6 89.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.549 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -64.69 -42.34 95.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.269 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 93.8 t80 -63.75 -52.34 60.86 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.826 0.346 . . . . 0.0 111.653 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 20.3 tt -68.8 -35.3 68.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.547 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . 0.415 ' O ' ' CB ' ' A' ' 183' ' ' ARG . 0.8 OUTLIER -49.71 -34.46 18.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.575 -179.699 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . 0.404 ' C ' ' O ' ' A' ' 179' ' ' ASN . 88.1 mt-30 -37.86 -43.01 0.65 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.671 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -104.62 -44.85 4.78 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.811 0.339 . . . . 0.0 111.272 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . 0.43 ' N ' ' CD2' ' A' ' 182' ' ' LEU . 4.1 mm? -60.97 -36.57 79.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.551 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . 0.415 ' CB ' ' O ' ' A' ' 179' ' ' ASN . 64.0 ttm-85 -51.89 -42.29 62.59 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.726 -179.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.4 m -61.44 -52.3 65.13 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.689 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.64 -40.81 76.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.83 0.348 . . . . 0.0 110.808 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.72 -43.77 96.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.316 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.0 ttp85 -59.72 -53.04 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.613 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 21.4 m -63.22 -40.43 97.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 49.9 tp -42.02 -70.57 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.561 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -175.32 25.57 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.636 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 19.8 tpt85 -115.24 132.45 56.61 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.954 0.407 . . . . 0.0 110.429 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 55.43 41.47 30.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.404 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . 0.526 ' O ' ' N ' ' A' ' 195' ' ' ASP . . . -63.31 161.62 34.02 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 87.1 mmm 45.11 -89.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.693 0.283 . . . . 0.0 110.515 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 193' ' ' GLY . 53.3 t0 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.477 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 55.45 43.89 27.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.938 0.399 . . . . 0.0 110.502 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -58.46 -44.02 89.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.769 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.7 p 62.17 20.76 11.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.821 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 52.4 p -67.16 -33.49 75.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.715 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -91.46 93.95 9.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.427 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.9 t -85.99 -82.29 0.2 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.584 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -107.46 143.71 35.43 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.653 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.518 ' CD2' ' N ' ' A' ' 69' ' ' LEU . 3.8 mm? -88.72 1.65 54.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.484 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 90.75 -154.32 23.1 Favored Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -67.52 134.13 50.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.111 0.482 . . . . 0.0 110.355 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 37.2 pt -152.74 -138.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.482 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -73.36 50.41 0.3 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.313 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.502 ' O ' ' N ' ' A' ' 76' ' ' SER . . . 61.85 22.01 12.69 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.895 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 29.1 t0 41.11 22.97 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.92 0.39 . . . . 0.0 110.424 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.57 ' C ' ' H ' ' A' ' 78' ' ' SER . 7.1 t 40.64 38.96 0.68 Allowed 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.523 -179.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.498 ' O ' ' CB ' ' A' ' 78' ' ' SER . 75.3 tt0 69.32 -37.03 0.36 Allowed 'General case' 0 C--N 1.332 -0.171 0 O-C-N 123.919 0.762 . . . . 0.0 110.288 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.57 ' H ' ' C ' ' A' ' 76' ' ' SER . 1.2 p 158.48 0.19 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.522 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -66.06 -20.76 66.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.592 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.15 -38.7 80.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.459 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.65 -46.91 86.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.815 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.13 -43.75 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 -179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.407 HD11 HG23 ' A' ' 83' ' ' ILE . 96.5 mt -62.74 -42.85 97.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -54.89 -47.32 74.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.658 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -62.02 -43.17 99.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.029 0.442 . . . . 0.0 110.516 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.7 mt -59.51 -44.25 92.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.72 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.74 -40.95 98.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.02 0.438 . . . . 0.0 110.243 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -54.65 -45.34 73.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.532 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -65.02 -41.45 95.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.603 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 94' ' ' GLY . 9.5 mt -66.43 -39.56 89.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.479 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.62 -46.46 77.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.184 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -61.68 -52.14 65.53 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.028 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.02 -25.84 36.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.7 -29.15 24.67 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.446 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.7 t70 -61.34 -45.84 92.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.785 0.326 . . . . 0.0 110.727 -179.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 90.0 p -136.45 104.91 5.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.934 0.397 . . . . 0.0 110.466 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 39.1 ttp -127.35 -16.86 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.373 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' A' ' 101' ' ' ILE . 98.5 m-20 -64.9 -31.5 72.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.575 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -65.09 -40.4 94.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.186 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m -60.57 -44.16 96.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.943 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.461 ' O ' ' O ' ' A' ' 98' ' ' ASP . 2.8 pt -99.81 149.53 36.02 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.066 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -36.64 104.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.352 0 C-N-CA 122.548 2.166 . . . . 0.0 112.12 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -77.87 179.52 6.42 Favored 'Trans proline' 0 C--N 1.314 -1.269 0 C-N-CA 122.243 1.962 . . . . 0.0 112.023 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 91.1 -16.27 59.05 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt -68.89 -32.55 72.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.871 0.367 . . . . 0.0 110.31 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 12.2 p -59.53 -32.9 50.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.532 -179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.9 -44.72 96.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.89 -41.09 91.34 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.76 -44.31 96.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.145 0.498 . . . . 0.0 110.401 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.04 93.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.61 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.419 ' O ' ' N ' ' A' ' 115' ' ' ASN . 63.7 mt -63.28 -41.49 99.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.628 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -58.18 -47.34 83.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.455 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 64.6 tp -68.73 -43.46 75.87 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 121.544 0.688 . . . . 0.0 110.31 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.56 -37.52 86.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.216 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.419 ' N ' ' O ' ' A' ' 111' ' ' LEU . 40.0 t30 -63.9 -44.35 93.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.028 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.0 t -87.07 28.26 0.94 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.793 0.33 . . . . 0.0 110.416 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 84.7 p -78.84 -3.19 43.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.355 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 44.4 ptt85 -74.96 50.36 0.46 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.489 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.2 m 56.93 95.92 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.661 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 77.2 tt0 -168.6 64.45 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.113 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.509 ' C ' ' H ' ' A' ' 123' ' ' ARG . 7.0 pt-20 -179.02 -171.69 0.22 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.197 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 57.82 3.71 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.511 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.509 ' H ' ' C ' ' A' ' 121' ' ' GLU . 88.5 mtm180 -75.32 -71.31 0.37 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.476 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.475 ' O ' ' N ' ' A' ' 126' ' ' ASP . 99.1 m-20 -64.83 -39.55 93.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.451 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -66.18 66.92 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.45 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.475 ' N ' ' O ' ' A' ' 124' ' ' ASN . 65.1 t0 -134.18 -85.59 0.42 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.836 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 65.9 mt -54.49 -31.44 55.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.714 0.292 . . . . 0.0 110.671 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.16 -47.06 75.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.421 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 23.4 m -63.68 -44.21 94.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.9 -47.74 81.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.615 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.95 -41.16 95.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.415 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -61.7 -48.88 78.77 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.98 -44.61 95.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.658 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.78 -53.32 57.57 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.306 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -38.92 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.463 -0.495 . . . . 0.0 109.857 -178.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -57.49 -36.97 72.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.624 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -117.3 62.6 0.74 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.743 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.665 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 1.9 t80 -84.88 -34.56 0.53 Allowed Pre-proline 0 CA--C 1.542 0.673 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.239 178.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.665 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 39.8 Cg_exo -55.79 108.9 0.36 Allowed 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.024 1.816 . . . . 0.0 111.75 -178.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.416 ' O ' ' N ' ' A' ' 142' ' ' MET . 20.3 ptp180 -153.72 152.3 30.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.248 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.488 ' O ' ' N ' ' A' ' 143' ' ' GLU . 99.7 m-20 43.53 -97.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.384 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' MET . . . . . 0.416 ' N ' ' O ' ' A' ' 140' ' ' ARG . 30.5 ttm 63.88 -65.33 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.527 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 141' ' ' ASP . 22.6 pt-20 -53.87 -35.32 61.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.197 0.522 . . . . 0.0 110.718 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . 0.488 ' O ' ' OG1' ' A' ' 147' ' ' THR . 47.1 tttp -64.16 -34.82 78.96 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.281 0.563 . . . . 0.0 111.147 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.78 -48.9 65.04 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.773 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -70.31 -31.69 69.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.004 0.43 . . . . 0.0 110.367 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 144' ' ' LYS . 12.2 p -60.11 -45.92 91.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.032 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mtm -62.49 -46.06 90.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.059 179.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' A' ' 149' ' ' LEU . 4.2 mm? -65.35 -47.41 76.55 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 119.591 -0.844 . . . . 0.0 110.256 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 45.7 t -60.89 -41.08 87.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.561 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.1 tp -57.79 -45.21 86.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.629 -179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.01 -41.26 95.52 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.613 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.69 -43.51 98.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.607 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.9 mt -60.78 -43.54 97.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.161 0.505 . . . . 0.0 110.031 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -44.48 96.24 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.685 -179.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.73 -35.99 75.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.495 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.14 -48.85 79.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.453 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -64.0 -40.72 97.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.916 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 76.9 t -66.32 -46.11 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.931 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -66.06 -36.06 82.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.962 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.6 p -159.17 162.92 36.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.548 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -88.87 -161.61 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 12.9 p -84.95 147.84 49.26 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.973 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -41.48 -71.79 0.05 OUTLIER 'Trans proline' 0 N--CA 1.49 1.31 0 C-N-CA 122.284 1.99 . . . . 0.0 112.456 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' SER . . . . . 0.54 ' OG ' ' N ' ' A' ' 166' ' ' LEU . 4.9 t 170.59 -111.05 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.997 -179.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . 0.54 ' N ' ' OG ' ' A' ' 165' ' ' SER . 85.6 mt -98.95 -7.75 26.56 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.009 0.433 . . . . 0.0 110.728 -179.806 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.428 ' N ' ' CD1' ' A' ' 167' ' ' LEU . 10.4 mp -65.91 -25.73 67.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.123 179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -59.93 -41.99 92.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.698 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -68.25 -46.37 70.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.124 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.08 -45.94 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.473 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -60.05 -39.31 85.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.371 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.51 -49.25 78.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.348 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 23.8 m -61.07 -46.86 88.93 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.062 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.3 m -52.66 -42.42 64.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.125 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.4 -44.34 99.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.773 0.321 . . . . 0.0 110.688 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -70.88 -35.79 72.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -58.03 -42.15 84.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.41 -179.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.5 mt -60.84 -42.17 91.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.356 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . 0.692 ' ND2' HH21 ' A' ' 183' ' ' ARG . 3.4 m120 -50.79 -34.19 26.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.985 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . 0.461 ' O ' ' O ' ' A' ' 179' ' ' ASN . 57.6 tt0 -35.13 -95.73 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.734 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -130.5 -12.5 3.91 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.63 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 56.6 mt -61.95 -36.19 80.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.398 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . 0.692 HH21 ' ND2' ' A' ' 179' ' ' ASN . 42.2 ttm180 -51.32 -45.78 62.36 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.965 -178.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.1 m -62.63 -51.29 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.121 0.486 . . . . 0.0 110.008 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -62.08 -40.33 95.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.203 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 42.0 t -62.7 -44.2 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.616 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 67.2 mmt-85 -58.05 -53.62 56.23 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.148 -178.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 69.1 m -58.56 -40.92 84.42 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.497 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 84.8 mt -86.27 84.37 7.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.386 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . 44.7 -165.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.431 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 10.5 ptp85 -141.02 147.21 38.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.372 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -90.49 108.44 19.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.666 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -62.33 -43.27 99.31 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 50.4 ttp -163.62 144.07 8.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.765 0.317 . . . . 0.0 110.607 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.542 179.897 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -63.53 -41.17 98.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.69 0.281 . . . . 0.0 110.834 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -87.65 138.33 31.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.563 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.3 p -79.6 65.78 4.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.561 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.9 p -77.29 161.57 28.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.514 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.498 ' CG ' ' N ' ' A' ' 67' ' ' SER . 16.5 t-80 -154.08 -101.23 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.572 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.498 ' N ' ' CG ' ' A' ' 66' ' ' HIS . 54.1 m -83.36 -8.19 59.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.692 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -63.59 -40.65 97.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.588 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.02 -42.17 99.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.612 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 58.45 -87.74 0.02 OUTLIER Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.4 ptt-85 -145.86 156.71 43.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.783 0.325 . . . . 0.0 110.668 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.5 tt -139.18 155.09 26.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.331 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 65.93 35.66 6.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.149 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -167.89 1.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.686 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.486 ' O ' ' N ' ' A' ' 77' ' ' GLU . 29.8 t70 -158.13 -106.07 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.402 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.402 ' N ' ' CG ' ' A' ' 75' ' ' ASP . 3.7 t 41.55 22.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.651 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.486 ' N ' ' O ' ' A' ' 75' ' ' ASP . 83.1 tt0 -139.65 75.06 1.49 Allowed 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.508 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.4 t 171.44 -37.54 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.428 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.49 -34.54 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.406 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -60.13 -39.51 86.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.325 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -62.12 -46.16 90.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.445 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.403 HD13 HG23 ' A' ' 82' ' ' ILE . 97.4 mt -65.69 -43.73 93.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.604 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.2 mt -60.69 -41.73 89.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -58.36 -55.05 40.03 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.803 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -52.86 -52.25 57.99 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.668 -178.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.59 -51.21 73.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.043 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -57.36 -36.86 71.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.26 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -61.87 -45.91 91.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.526 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -66.02 -43.29 88.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.931 0.396 . . . . 0.0 110.14 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.558 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.8 mp -71.42 -33.69 69.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.048 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.486 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -56.9 -48.43 78.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.439 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -72.18 -52.54 16.07 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.906 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 88.3 t -66.68 -26.33 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 121.039 0.447 . . . . 0.0 110.745 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -75.97 -37.04 39.51 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.13 -47.6 79.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.495 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.3 p -106.16 106.67 17.29 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 110.383 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.462 ' O ' ' SD ' ' A' ' 97' ' ' MET . 2.3 tmm? -171.0 -32.6 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 98' ' ' ASP . 35.5 p-10 -65.67 -22.87 66.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.956 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -60.5 -38.57 84.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.7 t -62.92 -42.48 99.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.621 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 6.4 pt -144.33 76.34 14.75 Favored Pre-proline 0 N--CA 1.463 0.205 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.343 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -45.22 106.42 0.09 OUTLIER 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.434 2.089 . . . . 0.0 111.839 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.98 -163.93 0.25 Allowed 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.433 2.089 . . . . 0.0 112.274 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 87.32 -18.85 34.73 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.0 mt -66.78 -41.62 87.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.007 0.432 . . . . 0.0 110.383 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 3.2 m -66.44 -37.74 80.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.71 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -62.43 -41.31 98.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 0.0 110.194 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -67.89 -48.72 53.11 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.34 -41.47 98.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.142 0.496 . . . . 0.0 110.335 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.46 -48.44 74.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.337 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.73 -43.11 97.49 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.615 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -61.78 -34.93 76.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.728 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 40.0 mt -62.73 -42.68 99.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.31 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -78.12 -20.75 51.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.169 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -62.73 -34.79 77.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.307 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.2 m -60.11 -47.93 83.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.656 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.5 m -87.74 -76.25 0.38 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.914 0.388 . . . . 0.0 110.361 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.418 ' O ' ' OG ' ' A' ' 119' ' ' SER . 53.6 ttt-85 45.55 33.01 1.25 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.711 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 118' ' ' ARG . 24.9 m -171.9 -38.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.521 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -64.97 -39.14 93.04 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.474 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -66.64 -35.6 80.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.786 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -80.13 88.0 5.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 15.7 tpt85 -174.0 -66.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.471 179.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -63.34 -41.29 98.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.524 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -75.99 -5.67 47.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.613 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -48.96 -69.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 -179.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.7 mt -65.4 -34.71 78.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.729 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.42 -44.68 72.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.6 m -63.73 -46.56 84.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.401 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.19 -43.45 95.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.771 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 81.2 mt -61.64 -43.6 98.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.79 0.329 . . . . 0.0 110.22 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -68.65 -46.42 69.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.288 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -62.02 -51.49 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.748 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.5 tp -63.7 -47.9 79.29 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.855 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.33 -28.54 66.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.898 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -55.41 -25.29 35.02 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.169 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -93.76 -92.26 0.18 Allowed 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.496 ' CD2' ' O ' ' A' ' 138' ' ' TYR . 83.6 t80 61.29 64.7 2.07 Favored Pre-proline 0 C--O 1.231 0.125 0 CA-C-O 120.948 0.404 . . . . 0.0 110.878 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.415 ' O ' ' O ' ' A' ' 140' ' ' ARG . 73.0 Cg_endo -84.49 -36.79 0.15 Allowed 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.101 1.867 . . . . 0.0 112.257 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.415 ' O ' ' O ' ' A' ' 139' ' ' PRO . 75.3 mtp180 -52.64 -171.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.562 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.404 ' CG ' ' HH ' ' A' ' 138' ' ' TYR . 29.4 m-20 54.81 33.51 19.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.798 179.426 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 36.2 ttm -125.57 -58.19 1.43 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.791 0.329 . . . . 0.0 110.601 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -66.32 -35.35 80.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.566 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 20.6 tptt -60.58 -34.06 73.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.146 0.498 . . . . 0.0 110.457 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -76.56 -35.92 57.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.529 178.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -68.54 -47.13 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.555 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 73.3 m -61.92 -42.63 99.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.116 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 48.5 tpp -54.76 -46.25 74.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.97 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 94.6 mt -70.06 -46.71 64.39 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.724 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 76.3 t -60.05 -44.75 95.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.542 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.2 tt -61.46 -44.82 96.42 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.042 0.449 . . . . 0.0 110.866 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.48 89.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 43.1 tp -58.46 -40.77 83.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.187 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.46 -43.87 96.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.251 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 96.7 mt -65.48 -46.57 79.24 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.318 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.24 -40.39 90.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.095 0.474 . . . . 0.0 110.194 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.493 ' O ' ' N ' ' A' ' 161' ' ' SER . 19.3 tptm -64.49 -35.33 80.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.719 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.24 -40.31 95.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.322 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 57.8 t -75.85 -50.24 23.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.865 179.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.65 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -67.69 -50.1 59.38 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.814 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.493 ' N ' ' O ' ' A' ' 157' ' ' LYS . 66.8 m 25.12 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.739 0.649 . . . . 0.0 111.487 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.65 ' N ' ' O ' ' A' ' 160' ' ' ALA . 90.0 m-70 -147.88 120.58 8.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.285 -177.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.37 175.57 2.65 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.319 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -57.23 -153.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.473 2.115 . . . . 0.0 111.753 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 3.4 m -152.82 -71.19 0.15 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.416 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 57.4 mt -64.34 -39.91 94.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.538 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.39 -37.52 87.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.405 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -59.74 -44.94 93.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.577 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -64.45 -44.12 92.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.95 0.405 . . . . 0.0 110.709 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 92.9 t -64.42 -44.16 97.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.786 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -59.92 -42.18 93.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.419 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.9 -49.3 78.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.493 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.8 m -59.41 -46.19 89.4 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.058 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.6 m -52.57 -44.99 66.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.825 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 75.0 t -58.93 -41.69 83.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.078 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . 0.403 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 55.5 t-20 -61.49 -39.5 91.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -59.01 -41.26 87.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.69 0.281 . . . . 0.0 110.676 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 36.0 mm -61.88 -40.91 88.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.236 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -64.59 -35.9 82.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.094 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -54.92 -102.42 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.844 0.354 . . . . 0.0 111.068 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 41.9 p-10 -80.88 72.32 7.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.775 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 63.1 tp -64.14 -42.76 96.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.723 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -60.51 -38.33 84.01 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.531 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 72.5 m -59.14 -44.95 92.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.229 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -61.84 -39.63 92.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.452 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.4 t -60.67 -48.72 87.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.513 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -63.82 -32.79 74.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.27 0.557 . . . . 0.0 110.687 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 16.3 m -57.34 -33.21 67.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.287 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.431 ' N ' ' CD2' ' A' ' 189' ' ' LEU . 4.1 mm? -87.45 -4.01 59.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.525 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . 67.11 41.4 2.62 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.486 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 79.2 ttt-85 -65.12 -38.99 92.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.338 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -59.34 -40.19 85.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.464 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -160.37 165.24 34.85 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 14.7 ptp -71.57 150.28 44.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.735 0.302 . . . . 0.0 110.373 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.567 -179.993 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -63.5 -41.88 98.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 110.621 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.472 ' C ' ' H ' ' A' ' 65' ' ' SER . 63.0 ttm-85 -65.48 -42.13 92.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.326 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.2 p -76.41 35.61 0.15 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.77 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.472 ' H ' ' C ' ' A' ' 63' ' ' ARG . 38.5 t -63.68 -16.78 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.538 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.0 m80 49.59 -111.16 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.491 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.9 t -158.67 151.97 22.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.587 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -80.55 136.85 36.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.359 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.2 mt -116.18 123.75 48.57 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.219 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -108.89 -159.2 19.23 Favored Glycine 0 N--CA 1.463 0.444 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -70.74 134.88 47.82 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.895 0.379 . . . . 0.0 110.573 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.448 ' CG1' ' N ' ' A' ' 73' ' ' GLU . 16.5 tt -134.79 166.08 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.602 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.448 ' N ' ' CG1' ' A' ' 72' ' ' ILE . 97.0 mt-10 -46.99 -45.62 21.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.49 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.63 ' O ' ' N ' ' A' ' 76' ' ' SER . . . -40.0 -75.79 0.03 OUTLIER 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.674 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 79' ' ' GLN . 67.6 t0 40.72 -83.12 0.0 OUTLIER 'General case' 0 CA--C 1.526 0.055 0 O-C-N 123.53 0.519 . . . . 0.0 111.069 179.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.63 ' N ' ' O ' ' A' ' 74' ' ' ALA . 48.1 t -57.13 -44.07 82.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.313 179.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -68.67 -34.32 75.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.345 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 p -118.55 43.8 2.42 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.321 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.52 ' N ' ' O ' ' A' ' 75' ' ' ASP . 56.3 tt0 -61.97 -43.24 99.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.489 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -67.33 -33.77 75.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.506 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -60.5 -37.38 80.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.603 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.419 HD11 HG22 ' A' ' 82' ' ' ILE . 93.6 mt -62.7 -44.36 99.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.38 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.6 mt -63.79 -44.7 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -55.59 -43.89 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.857 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.458 ' OD1' ' CD2' ' A' ' 89' ' ' HIS . 45.9 t-20 -63.97 -42.52 97.21 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.003 0.43 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.7 mt -60.3 -44.49 95.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.111 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.6 -50.34 73.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.963 0.411 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 94.1 mtm-85 -54.07 -45.95 71.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.458 ' CD2' ' OD1' ' A' ' 85' ' ' ASN . 36.1 m-70 -66.93 -41.82 86.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.075 0.464 . . . . 0.0 110.221 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' A' ' 94' ' ' GLY . 3.2 tt -64.58 -41.7 96.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.099 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.17 82.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.396 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -65.24 -52.21 55.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.423 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.8 t -71.39 -26.4 26.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.045 0.45 . . . . 0.0 110.657 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -79.91 -40.73 13.73 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.45 -47.08 77.41 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.663 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.0 p -75.0 -31.24 61.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 54.92 -170.54 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.257 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.667 ' C ' ' H ' ' A' ' 100' ' ' SER . 51.7 t0 -86.35 2.25 48.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 60.66 -10.4 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.654 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.667 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.9 m -80.38 -17.58 51.47 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.952 0.406 . . . . 0.0 110.08 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 3.3 pt -45.84 142.04 3.92 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.861 -179.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -37.19 100.67 0.03 OUTLIER 'Trans proline' 0 C--N 1.317 -1.104 0 C-N-CA 122.685 2.257 . . . . 0.0 112.363 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -80.81 155.6 20.55 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 122.615 2.21 . . . . 0.0 112.173 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 96.73 -29.51 10.35 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.3 mp -64.78 -35.21 80.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.874 0.368 . . . . 0.0 110.016 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 12.6 p -50.48 -36.32 13.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.399 -178.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -61.25 -40.07 92.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.871 0.367 . . . . 0.0 110.159 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.05 -39.89 81.08 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.468 ' CD1' ' N ' ' A' ' 109' ' ' LEU . 9.6 mp -63.58 -42.78 98.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.519 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -39.02 86.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.9 -39.8 95.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.358 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -57.98 -47.74 82.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.761 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.79 -21.83 63.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.618 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -87.73 -55.49 3.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.587 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 32.8 m -67.07 89.77 0.18 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.722 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 35.1 p -152.16 16.19 0.64 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.651 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 120' ' ' GLU . 14.5 ptp180 -125.44 138.2 54.0 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.662 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.6 m -48.17 88.62 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.425 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.529 ' N ' ' O ' ' A' ' 118' ' ' ARG . 72.2 mm-40 -142.74 -63.13 0.42 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.785 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -71.06 69.65 0.5 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.183 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -173.88 -38.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.621 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -69.4 -39.68 77.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.132 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -67.6 -49.15 64.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.45 -179.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -77.07 -10.48 59.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.735 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -45.13 -85.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.743 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.6 mt -51.48 -35.76 41.37 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.98 70.15 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.225 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 99.7 m -63.29 -42.12 99.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.105 179.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.01 80.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.15 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.96 -42.37 93.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.825 0.345 . . . . 0.0 110.339 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -63.94 -49.96 70.54 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.232 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.82 -36.45 83.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.498 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.62 -55.04 39.4 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.445 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.27 -31.65 70.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.977 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -56.43 -26.95 55.27 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.112 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -159.65 57.09 0.38 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.275 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.503 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 22.2 p90 -83.22 122.44 77.41 Favored Pre-proline 0 CA--C 1.54 0.596 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.733 -179.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.444 ' HG2' ' H ' ' A' ' 140' ' ' ARG . 63.8 Cg_endo -77.69 -78.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.462 0 C-N-CA 122.024 1.816 . . . . 0.0 112.39 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.508 ' O ' ' N ' ' A' ' 142' ' ' MET . 39.5 ttm180 58.57 145.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.381 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -45.6 91.72 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.401 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' MET . . . . . 0.508 ' N ' ' O ' ' A' ' 140' ' ' ARG . 47.9 ttp -128.79 -39.21 1.63 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.542 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -65.26 -44.6 87.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -61.57 -49.58 76.08 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.784 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.44 -35.24 65.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.757 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -69.17 -49.85 52.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.209 0.528 . . . . 0.0 110.884 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 54.4 m -71.0 -41.21 71.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.762 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 53.1 ttm -52.88 -46.17 67.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 75.8 mt -63.91 -49.77 71.36 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.292 179.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.24 -45.06 99.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.99 -46.68 88.17 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.184 0.516 . . . . 0.0 110.321 -179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -59.03 -41.27 87.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.146 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 49.1 tp -59.75 -41.66 91.47 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.334 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.58 -42.86 97.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.004 0.43 . . . . 0.0 110.223 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.73 -46.53 87.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.205 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.17 -37.21 78.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . 0.594 ' HZ3' ' NH1' ' A' ' 168' ' ' ARG . 88.6 tttt -62.29 -45.03 95.08 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.563 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -63.03 -38.09 89.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.5 t -66.33 -44.79 90.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.569 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.439 ' O ' ' OG ' ' A' ' 161' ' ' SER . . . -68.44 -39.78 81.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.362 -179.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 160' ' ' ALA . 37.7 m -171.1 173.49 5.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 -179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.584 ' ND1' ' N ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER 179.25 69.08 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 84.7 m -116.87 81.7 12.37 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.42 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . 0.436 ' O ' ' CB ' ' A' ' 165' ' ' SER . 73.0 Cg_endo -82.04 -179.44 4.76 Favored 'Trans proline' 0 C--N 1.312 -1.361 0 C-N-CA 122.681 2.254 . . . . 0.0 111.872 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 0.7 OUTLIER 79.35 25.65 0.43 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 179.395 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 82.0 mt -143.98 -106.12 0.12 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.849 0.357 . . . . 0.0 110.569 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.531 ' H ' ' CD2' ' A' ' 167' ' ' LEU . 2.0 pt? -59.59 -26.24 65.26 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.317 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.594 ' NH1' ' HZ3' ' A' ' 157' ' ' LYS . 55.5 mtp85 -72.18 -40.85 67.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.893 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.03 -47.05 84.7 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.989 0.423 . . . . 0.0 111.275 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 5.8 p -65.41 -41.36 90.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.235 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -61.59 -40.9 96.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.356 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -58.21 -47.97 81.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.353 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.7 m -58.46 -42.5 87.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.896 0.379 . . . . 0.0 110.434 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 72.3 m -57.32 -42.71 82.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.081 0.467 . . . . 0.0 110.305 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.06 -40.95 84.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.359 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -60.56 -39.09 86.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.955 0.407 . . . . 0.0 110.384 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -60.75 -46.62 89.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.984 0.421 . . . . 0.0 110.506 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 54.5 mt -69.59 -35.76 67.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.649 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -50.09 -34.44 21.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.618 -179.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -65.91 -36.25 82.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.795 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -121.01 38.47 4.05 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.883 0.373 . . . . 0.0 110.508 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.64 -43.02 99.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.299 0.571 . . . . 0.0 110.2 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.75 -47.28 80.42 Favored 'General case' 0 C--N 1.321 -0.63 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.137 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.4 m -59.2 -43.72 92.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.089 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.2 -38.97 84.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.56 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -59.75 -49.6 83.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.082 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 91.3 mtt-85 -68.46 -52.33 33.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 74.6 m -57.84 -37.04 73.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.115 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.423 ' O ' ' O ' ' A' ' 190' ' ' ALA . 3.2 tt -101.46 107.69 19.07 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.085 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . 0.423 ' O ' ' O ' ' A' ' 189' ' ' LEU . . . 58.22 117.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.381 179.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -72.21 131.47 42.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.38 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 63.0 t-20 -104.53 112.35 25.38 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.457 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -134.06 -106.6 0.93 Allowed Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 65.6 mtt 49.73 46.1 24.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.812 0.339 . . . . 0.0 110.516 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 68.2 t0 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.543 -179.976 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -63.41 -41.85 98.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.741 0.305 . . . . 0.0 110.452 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -140.83 -49.89 0.44 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.449 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m -142.62 119.57 11.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.966 0.412 . . . . 0.0 110.381 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.436 ' HG ' ' CD2' ' A' ' 90' ' ' LEU . 49.6 m -160.58 165.16 31.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.375 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.431 ' O ' ' O ' ' A' ' 67' ' ' SER . 74.0 m80 -97.74 99.54 10.89 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.382 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.431 ' O ' ' O ' ' A' ' 66' ' ' HIS . 88.0 p 39.64 -162.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.815 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -158.56 109.65 2.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.233 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.532 ' CD2' ' N ' ' A' ' 69' ' ' LEU . 3.8 mm? -88.5 131.96 34.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.938 0.399 . . . . 0.0 110.679 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 167.07 51.32 0.03 OUTLIER Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.164 -0.775 . . . . 0.0 111.164 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.547 ' N ' ' CD ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -154.36 7.28 0.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.689 0.28 . . . . 0.0 110.759 -179.887 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.4 tt -78.97 32.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.284 0.564 . . . . 0.0 110.271 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.469 ' H ' ' C ' ' A' ' 71' ' ' ARG . 97.2 mt-10 56.56 33.66 23.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.582 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -137.71 -3.07 1.88 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 110.697 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -64.62 -33.46 75.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.699 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 78' ' ' SER . 86.7 p -59.59 163.35 4.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.651 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.497 ' C ' ' H ' ' A' ' 79' ' ' GLN . 79.9 tt0 58.66 -75.8 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.416 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 76' ' ' SER . 41.5 t -66.14 4.68 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.543 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . 0.497 ' H ' ' C ' ' A' ' 77' ' ' GLU . 58.8 tt0 -45.36 -36.39 4.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.99 -43.38 98.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.058 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.66 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.005 0.431 . . . . 0.0 110.315 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 36.2 mm -63.2 -43.05 98.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.521 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.61 -43.75 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.107 0.479 . . . . 0.0 110.227 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.5 ttm-85 -70.58 -55.15 9.51 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.683 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -52.99 -50.52 64.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.088 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.507 ' CG2' ' N ' ' A' ' 87' ' ' ALA . 4.0 tp -65.12 -45.74 93.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.034 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.507 ' N ' ' CG2' ' A' ' 86' ' ' ILE . . . -62.63 -36.53 83.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.444 -179.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -59.94 -48.65 80.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.572 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -66.58 -40.04 88.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.204 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.436 ' CD2' ' HG ' ' A' ' 65' ' ' SER . 82.0 mt -67.52 -35.06 78.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.891 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.5 -48.27 75.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.239 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -65.87 -52.8 47.13 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.124 -0.63 . . . . 0.0 110.573 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.4 p -66.29 -26.47 38.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.628 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.93 -27.3 29.17 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -73.58 -47.38 41.01 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.798 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.0 m -71.02 -5.04 28.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.862 0.363 . . . . 0.0 110.766 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.2 ttt -62.4 -38.53 90.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -65.43 -33.33 75.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.4 ttt85 -55.58 -44.61 77.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.487 -179.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.6 m -71.85 -23.43 61.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.167 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 49.0 mm -118.68 80.23 17.07 Favored Pre-proline 0 N--CA 1.47 0.564 0 CA-C-O 120.808 0.337 . . . . 0.0 110.685 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -48.51 147.49 9.16 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.671 2.247 . . . . 0.0 112.677 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -70.45 152.21 65.58 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.518 2.146 . . . . 0.0 112.381 179.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 108' ' ' GLY . . . 83.39 -47.49 3.84 Favored Glycine 0 CA--C 1.524 0.617 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.792 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.9 mp -63.64 -45.72 88.93 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.578 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 7.3 p -68.44 -47.04 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.724 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -68.98 -35.73 77.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.717 179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' A' ' 104' ' ' GLY . . . -57.84 -15.94 22.11 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.83 -47.9 78.96 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.824 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.6 -38.54 80.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.5 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.81 -39.36 94.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.824 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.89 -47.74 76.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.65 -179.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.503 ' C ' ' H ' ' A' ' 115' ' ' ASN . 4.0 mm? -68.56 -42.31 78.52 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.374 179.155 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -47.7 -14.59 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.075 0.464 . . . . 0.0 110.481 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.503 ' H ' ' C ' ' A' ' 113' ' ' LEU . 10.0 m120 -61.17 -40.72 94.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.395 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 t -68.21 -38.87 82.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.13 0.491 . . . . 0.0 110.714 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 81.1 p -77.88 47.7 0.65 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.8 ptt85 -62.29 -35.99 80.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.524 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.2 p -76.27 -86.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.643 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -172.69 -51.75 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.547 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 57.83 24.63 11.04 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.837 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -101.12 9.3 42.17 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.797 0.332 . . . . 0.0 110.926 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 85.9 mtm-85 -65.29 -38.19 89.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.071 -179.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -62.85 -44.37 96.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.251 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.4 ptp180 -77.79 -7.64 56.88 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.02 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -43.03 -71.7 0.08 Allowed 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.626 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 58.0 mt -62.13 -35.76 79.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 120.639 0.256 . . . . 0.0 110.826 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -43.91 71.4 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.092 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.9 m -63.32 -47.66 81.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.239 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.58 -47.66 85.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.283 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.05 -40.44 97.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.446 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.47 -50.63 73.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.524 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -57.42 -44.7 84.87 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.702 -0.399 . . . . 0.0 109.962 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.91 -48.99 77.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.76 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.28 -42.2 86.04 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.94 -178.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -61.83 -28.22 69.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.98 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -135.16 94.1 3.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.902 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.468 ' O ' ' CD2' ' A' ' 138' ' ' TYR . 85.4 t80 -157.33 78.36 3.7 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.872 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -45.77 104.12 0.06 OUTLIER 'Trans proline' 0 C--N 1.307 -1.655 0 C-N-CA 122.445 2.097 . . . . 0.0 111.832 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 30.2 mmt180 -45.03 127.36 6.55 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.56 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -79.44 86.23 5.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.958 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 5.8 ptp -145.37 -46.66 0.22 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.031 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -64.02 -49.34 72.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.443 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -65.85 -40.76 92.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.67 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.81 -35.3 76.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.417 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -72.02 -35.82 69.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.912 0.387 . . . . 0.0 110.45 178.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 77.4 m -59.74 -44.06 93.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.025 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 51.0 mtt -61.04 -45.33 95.2 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.492 -0.483 . . . . 0.0 109.737 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.72 -43.14 94.38 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.702 179.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 47.3 t -62.1 -43.25 97.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.528 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.28 -44.42 88.46 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.315 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.47 90.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.004 0.43 . . . . 0.0 110.493 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 18.9 tp -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.448 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -47.81 84.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.453 . . . . 0.0 110.253 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.0 tp -67.14 -45.27 77.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.272 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.22 87.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.618 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.0 -37.81 83.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.286 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -62.54 -43.08 99.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.125 0.488 . . . . 0.0 110.509 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.8 t -67.15 -43.83 88.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.335 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.69 -35.63 80.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.897 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 29.5 m -159.84 161.99 34.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.379 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.448 ' O ' ' OG1' ' A' ' 163' ' ' THR . 65.4 m80 -98.56 -26.19 14.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.736 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' THR . . . . . 0.448 ' OG1' ' O ' ' A' ' 162' ' ' HIS . 4.3 p 64.04 145.19 0.08 OUTLIER Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.494 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -71.67 155.66 58.5 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.466 2.111 . . . . 0.0 111.943 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' SER . . . . . 0.418 ' O ' ' N ' ' A' ' 167' ' ' LEU . 8.7 t -93.13 -153.58 0.36 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 7.9 tp 66.77 -60.92 0.33 Allowed 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.58 0.55 . . . . 0.0 110.699 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.418 ' N ' ' O ' ' A' ' 165' ' ' SER . 53.7 mt -63.28 -33.38 75.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.274 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -64.4 -45.83 85.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.553 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -66.12 -43.67 86.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.478 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 82.8 t -63.93 -44.94 98.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.348 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -61.0 -41.34 96.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.45 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -63.45 -49.68 72.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.815 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 16.4 m -61.74 -42.6 99.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.806 0.336 . . . . 0.0 110.432 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.7 m -53.87 -44.09 70.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.585 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.4 t -64.29 -42.12 94.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.807 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -72.09 -38.6 69.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.267 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -60.85 -43.02 98.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.796 -179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . 0.407 HG21 HD12 ' A' ' 178' ' ' ILE . 95.1 mt -62.32 -39.88 85.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.105 0.479 . . . . 0.0 109.914 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 180' ' ' GLN . 61.8 t30 -48.87 -34.15 12.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.816 -179.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . 0.486 ' O ' ' O ' ' A' ' 179' ' ' ASN . 81.7 mm-40 -32.3 -99.33 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 O-C-N 124.043 0.839 . . . . 0.0 110.652 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -128.95 -14.25 4.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.335 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . 0.412 ' O ' ' N ' ' A' ' 186' ' ' VAL . 55.5 mt -58.87 -35.24 72.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.827 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . 0.466 ' CZ ' ' OD1' ' A' ' 179' ' ' ASN . 44.1 ttm180 -51.0 -42.15 60.17 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.154 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 85.5 m -72.36 -51.49 20.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.793 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -63.68 -49.35 73.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.385 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . 0.412 ' N ' ' O ' ' A' ' 182' ' ' LEU . 3.0 p -58.41 -35.01 52.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.148 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 59.5 ttt85 -59.68 -52.28 66.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.903 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 78.2 p -58.73 -48.71 80.22 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.694 -179.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.81 -40.42 95.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.525 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -75.28 67.1 1.84 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.513 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -93.44 3.0 56.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.826 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 45.7 p-10 -86.08 161.36 18.96 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.381 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -159.57 110.33 0.44 Allowed Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 194' ' ' MET . . . . . 0.458 ' SD ' ' O ' ' A' ' 194' ' ' MET . 0.0 OUTLIER -84.82 143.44 29.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.67 0.271 . . . . 0.0 110.507 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.614 179.915 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.37 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -64.46 -41.19 96.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.798 0.332 . . . . 0.0 110.712 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -72.48 142.69 48.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.317 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 t -61.26 -42.97 99.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.499 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.3 m 61.01 85.08 0.12 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.507 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -82.36 -11.8 58.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.493 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 82.5 p 51.26 -153.87 0.17 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.377 -179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.472 ' O ' ' O ' ' A' ' 69' ' ' LEU . 62.4 ttp180 -138.59 -62.59 0.56 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.559 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.502 ' C ' ' H ' ' A' ' 71' ' ' ARG . 10.3 mp 54.65 115.43 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.1 0.476 . . . . 0.0 110.522 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.447 ' O ' ' O ' ' A' ' 71' ' ' ARG . . . -75.68 29.33 1.27 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.039 -0.825 . . . . 0.0 111.039 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.502 ' H ' ' C ' ' A' ' 69' ' ' LEU . 16.5 mmm180 55.06 112.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.963 0.411 . . . . 0.0 110.523 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.0 pt -128.79 164.56 30.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.705 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 56.12 31.51 18.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.62 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -157.73 -14.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.493 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 40.1 p30 -75.08 -8.01 55.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.489 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 41.4 t -77.26 138.95 39.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.534 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 45.0 27.23 0.26 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.437 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.6 t -162.99 39.63 0.1 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.503 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -65.06 -30.49 71.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.772 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -38.84 82.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.538 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -63.05 -42.36 99.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.464 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.59 -44.78 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.415 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.4 mt -63.22 -43.66 98.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.92 0.391 . . . . 0.0 110.179 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -52.58 -54.42 33.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.825 -179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.685 HD22 ' HE2' ' A' ' 89' ' ' HIS . 14.9 t-20 -57.51 -40.94 79.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 110.672 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.4 mt -60.24 -52.87 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.277 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.54 72.69 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.117 0.484 . . . . 0.0 110.478 -179.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -61.08 -44.38 97.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.474 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.685 ' HE2' HD22 ' A' ' 85' ' ' ASN . 77.7 m-70 -66.38 -44.03 84.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.934 0.397 . . . . 0.0 110.648 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.563 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.3 mp -69.23 -35.09 75.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.572 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.52 -47.96 83.51 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.596 -179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -67.79 -52.44 37.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.344 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.4 t -66.86 -27.22 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -65.83 -39.55 95.15 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.42 -44.89 95.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.893 0.377 . . . . 0.0 110.632 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.469 ' C ' ' H ' ' A' ' 98' ' ' ASP . 68.9 m -77.32 -3.44 39.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.73 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.4 ttm -49.79 -13.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 96' ' ' SER . 88.9 m-20 -66.18 -11.25 48.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.505 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -73.51 -66.04 0.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.612 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.451 ' O ' ' C ' ' A' ' 101' ' ' ILE . 72.1 m -77.29 -70.87 0.44 Allowed 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.47 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.451 ' C ' ' O ' ' A' ' 100' ' ' SER . 1.4 tt 31.01 73.63 0.48 Allowed Pre-proline 0 C--O 1.223 -0.305 0 O-C-N 123.635 0.584 . . . . 0.0 110.97 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -76.88 112.73 3.49 Favored 'Trans proline' 0 C--N 1.298 -2.128 0 C-N-CA 121.973 1.782 . . . . 0.0 111.898 -178.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.499 ' O ' ' N ' ' A' ' 105' ' ' LEU . 72.1 Cg_endo -78.68 -8.44 15.84 Favored 'Trans proline' 0 C--N 1.314 -1.281 0 C-N-CA 122.547 2.165 . . . . 0.0 112.165 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.469 ' C ' ' O ' ' A' ' 103' ' ' PRO . . . -32.29 -35.55 0.02 OUTLIER Glycine 0 N--CA 1.466 0.658 0 N-CA-C 111.395 -0.682 . . . . 0.0 111.395 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' A' ' 103' ' ' PRO . 0.4 OUTLIER -83.95 40.35 0.75 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.179 0.514 . . . . 0.0 110.442 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.449 ' N ' ' O ' ' A' ' 103' ' ' PRO . 0.0 OUTLIER -70.34 -44.57 77.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.024 179.157 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 56.5 t-20 -57.01 -50.0 74.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.348 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -70.42 -46.56 48.01 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.427 ' O ' ' N ' ' A' ' 113' ' ' LEU . 47.2 tp -52.18 -47.75 65.37 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.929 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.32 74.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.275 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.414 ' O ' ' N ' ' A' ' 115' ' ' ASN . 82.4 mt -67.48 -46.88 71.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.005 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.459 ' O ' ' OG1' ' A' ' 116' ' ' THR . 5.6 tp-100 -64.4 -33.39 75.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.228 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 109' ' ' LEU . 53.6 tp -66.54 -39.26 88.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.945 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -91.17 -21.89 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.884 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 111' ' ' LEU . 96.7 m-20 -88.67 4.0 48.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 112' ' ' GLN . 54.0 m -72.43 -38.22 68.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.988 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 36.1 t -58.54 -43.48 89.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.043 -178.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -80.24 -21.85 42.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.046 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 116' ' ' THR . 82.4 p -67.64 -147.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.15 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 67.72 -59.63 0.41 Allowed 'General case' 0 C--N 1.332 -0.161 0 O-C-N 123.616 0.572 . . . . 0.0 110.45 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 119' ' ' SER . 17.0 pt-20 -88.51 -12.31 43.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.666 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -73.37 -13.01 61.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.729 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -67.98 -38.13 82.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.701 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -62.85 -37.52 87.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.445 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.438 ' O ' ' OG1' ' A' ' 129' ' ' THR . 38.4 mmt-85 -68.93 53.69 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.519 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -115.71 -70.9 0.77 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.535 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.5 mt -67.48 -43.56 80.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.804 0.335 . . . . 0.0 110.93 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.02 -32.78 74.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.436 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' THR . . . . . 0.438 ' OG1' ' O ' ' A' ' 125' ' ' ARG . 21.4 m -62.33 -52.66 62.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.324 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.53 88.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.33 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.7 tp -62.0 -48.69 79.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.25 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -59.33 -35.02 73.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.239 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -63.63 -40.48 97.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.594 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.0 tp -62.13 -44.34 96.85 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.619 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.424 ' N ' ' CD1' ' A' ' 135' ' ' LEU . 9.7 mp -74.83 -32.41 61.93 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.658 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -56.95 -41.16 77.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -122.31 72.55 1.06 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.703 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.449 ' O ' ' CG ' ' A' ' 138' ' ' TYR . 69.0 t80 -174.6 59.0 0.21 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.601 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -76.34 110.87 3.15 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.588 2.192 . . . . 0.0 111.741 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 61.7 ttt85 -149.22 143.98 26.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.453 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.94 110.16 3.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 74.6 mtm -101.23 -40.22 7.26 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.566 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.517 ' OE1' ' N ' ' A' ' 144' ' ' LYS . 7.1 tm-20 -70.71 -47.0 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . 0.517 ' N ' ' OE1' ' A' ' 143' ' ' GLU . 10.4 tptm -62.71 -48.42 79.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.841 -179.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.54 -50.78 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.355 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -63.48 -39.06 93.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.533 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' THR . . . . . 0.425 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 74.9 m -59.89 -46.86 88.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.567 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.6 mtm -64.58 -41.9 95.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.585 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 78.0 mt -63.69 -44.26 94.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.968 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 72.4 t -66.93 -43.14 89.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.432 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 55.4 tp -59.11 -46.6 87.89 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.474 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.6 -38.81 90.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.263 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.7 tp -63.68 -41.26 98.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.463 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 64.8 mt -60.22 -43.09 96.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.208 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.35 -41.84 98.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.242 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.87 -33.45 70.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.256 0.551 . . . . 0.0 110.502 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -72.46 -44.2 62.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.343 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.06 -48.2 77.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.489 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 14.9 p -62.18 -36.84 76.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.249 -179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -60.97 -51.35 69.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.625 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 23.7 p -24.14 141.47 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.793 0.683 . . . . 0.0 110.684 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.57 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.5 m-70 168.51 -38.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.36 156.68 75.97 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.384 -179.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.98 144.61 88.29 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.61 2.206 . . . . 0.0 111.713 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 85.0 p -91.74 -8.52 46.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 65.6 mt -61.0 -55.51 32.07 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.45 -179.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 54.3 tp -61.54 -42.28 98.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.235 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -65.39 -39.42 92.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.628 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -62.88 -46.63 86.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.997 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.488 ' O ' ' OG1' ' A' ' 173' ' ' THR . 77.1 t -64.3 -44.28 97.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.228 0.537 . . . . 0.0 110.17 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -57.62 -45.56 85.23 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.238 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -65.51 -41.88 92.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.86 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 18.6 p -58.82 -46.59 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.325 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.42 -43.96 88.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.029 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.9 t -59.71 -43.4 91.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.193 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -60.94 -39.73 90.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.655 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -60.91 -46.66 89.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.821 0.343 . . . . 0.0 110.483 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.99 -41.55 92.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.36 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . 0.428 ' O ' ' CB ' ' A' ' 183' ' ' ARG . 12.8 m120 -49.13 -34.42 14.08 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.354 -179.114 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -43.48 -30.59 0.58 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.124 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -107.87 -50.34 3.07 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.885 0.374 . . . . 0.0 110.914 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . 0.467 ' N ' ' CD2' ' A' ' 182' ' ' LEU . 4.1 mm? -60.68 -37.01 80.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.553 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' ARG . . . . . 0.564 HH12 ' NH1' ' A' ' 187' ' ' ARG . 73.8 ttt-85 -53.82 -41.37 67.27 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.379 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -60.29 -51.98 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.644 -179.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -67.92 -39.57 83.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.745 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.08 -42.47 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.705 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 187' ' ' ARG . . . . . 0.564 ' NH1' HH12 ' A' ' 183' ' ' ARG . 62.3 ttp180 -60.28 -45.23 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.773 -179.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 36.2 t -58.89 -51.22 70.96 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.762 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 189' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 189' ' ' LEU . 4.0 mm? -65.95 -40.39 91.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.674 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -171.42 -113.43 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.393 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -174.09 -54.04 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.713 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -81.25 142.97 32.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.556 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -143.98 17.33 2.16 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 87.2 mtp -83.1 139.75 33.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.824 0.345 . . . . 0.0 110.543 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 65.6 t0 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.58 -179.941 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.456 -0.128 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -58.88 -30.97 68.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.341 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.82 -35.15 79.68 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.195 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -62.78 -34.42 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.2 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.47 -43.76 98.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.349 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.87 -44.12 98.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -58.06 -44.51 87.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.112 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.96 -44.49 92.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 0.0 109.98 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.2 mt -61.58 -42.31 93.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.569 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.84 -51.49 68.79 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -52.31 -44.12 64.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.327 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -60.61 -50.75 72.25 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.99 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.549 ' O ' ' N ' ' A' ' 94' ' ' GLY . 11.7 mt -57.81 -38.32 75.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.974 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.81 74.13 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -57.52 -50.95 71.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.198 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.2 t -71.42 -26.23 26.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 121.229 0.538 . . . . 0.0 110.483 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.14 -28.57 68.06 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.216 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 98' ' ' ASP . 92.6 m-20 -68.79 -37.86 79.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.746 0.308 . . . . 0.0 111.139 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.1 t -71.25 -12.76 61.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.513 -179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 89.8 mmm -71.46 -10.42 59.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.732 0.301 . . . . 0.0 110.974 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' A' ' 95' ' ' ASP . 42.1 p-10 -98.59 8.52 44.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.731 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -155.79 38.44 0.37 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.918 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 56.7 p . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 120.869 0.366 . . . . 0.0 110.431 -179.974 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.731 ' N ' HD12 ' A' ' 105' ' ' LEU . 6.3 mp . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.729 0.3 . . . . 0.0 111.046 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 7.2 p -60.17 -33.74 54.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.607 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.6 t-20 -69.15 -50.14 50.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.107 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.89 -48.89 18.27 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.23 -44.15 96.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.808 0.337 . . . . 0.0 110.262 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.553 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.5 tp -66.27 -44.69 82.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.99 0.424 . . . . 0.0 110.55 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -67.62 -35.04 78.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.467 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.1 tp -60.78 -42.69 98.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.59 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -65.88 -39.29 90.54 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.746 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -62.83 -44.68 95.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.582 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 97.3 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.023 179.9 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.528 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 21.3 p-10 . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.417 0.151 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 54.9 mt -62.61 -35.73 80.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.545 0.212 . . . . 0.0 111.009 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.82 -41.36 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.324 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.5 m -61.77 -44.47 96.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.03 0.443 . . . . 0.0 110.15 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -46.58 80.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.6 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.88 -42.81 99.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.96 -52.84 37.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -59.63 -47.88 83.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.364 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.16 -48.8 76.91 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.268 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.24 -42.62 99.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 -179.663 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 70.0 mtp . . . . . 0 N--CA 1.467 0.386 0 CA-C-O 120.426 0.155 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 147' ' ' THR . 11.1 mt-10 -65.66 -43.79 88.29 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-O 120.876 0.37 . . . . 0.0 110.485 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -63.67 -31.03 72.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.776 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -75.86 -50.67 14.42 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.221 0.534 . . . . 0.0 110.924 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -68.25 -42.07 80.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.603 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.416 ' CB ' ' O ' ' A' ' 143' ' ' GLU . 99.6 m -62.15 -42.51 99.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.389 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 42.0 ttm -59.27 -46.33 88.81 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.65 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.3 -50.31 54.45 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.945 -0.702 . . . . 0.0 110.409 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -42.92 95.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.298 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.405 ' CB ' ' O ' ' A' ' 147' ' ' THR . 48.4 tp -60.93 -43.84 98.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.307 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.76 98.22 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.156 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 51.9 tp -60.62 -41.86 95.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.8 -41.76 96.28 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.103 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.416 ' O ' HG23 ' A' ' 159' ' ' VAL . 56.2 tp -62.33 -47.12 85.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.955 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.52 79.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -61.42 -45.83 92.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.384 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.86 -38.99 93.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.51 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 155' ' ' LEU . 83.4 t -66.58 -44.46 89.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.316 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.33 -39.52 92.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.187 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 64.0 m -164.55 167.16 19.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.162 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' HIS . . . . . 0.445 ' O ' ' C ' ' A' ' 163' ' ' THR . 33.2 m170 -112.63 115.55 28.76 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.445 ' C ' ' O ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER -29.39 93.55 0.05 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.442 0.464 . . . . 0.0 111.207 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 162' ' ' HIS . 32.5 Cg_exo -55.16 143.69 73.47 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 121.875 1.716 . . . . 0.0 112.291 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' SER . . . . . 0.445 ' O ' ' N ' ' A' ' 167' ' ' LEU . 11.0 p . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.828 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 165' ' ' SER . 50.2 mt . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 120.901 0.382 . . . . 0.0 110.356 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -64.35 -47.09 80.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.9 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.23 -46.74 85.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.393 . . . . 0.0 110.677 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.1 -44.84 97.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.322 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.45 -43.12 97.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -57.34 -48.89 77.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.721 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 17.7 m -59.9 -47.09 87.17 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.5 m -53.48 -43.06 67.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.117 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.4 t -61.48 -40.86 87.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.326 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 . . . . . 0 CA--C 1.53 0.176 0 CA-C-O 120.856 0.36 . . . . 0.0 110.417 -179.652 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 74.5 mt . . . . . 0 N--CA 1.462 0.149 0 CA-C-O 120.835 0.35 . . . . 0.0 110.646 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 183' ' ' ARG . . . . . 0.431 ' O ' ' CB ' ' A' ' 187' ' ' ARG . 39.2 mmt-85 -54.37 -31.33 54.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.539 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.6 m -58.15 -47.92 81.84 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.555 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -73.42 -48.1 36.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.003 0.43 . . . . 0.0 111.001 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 86.0 t -62.17 -44.6 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.772 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 187' ' ' ARG . . . . . 0.431 ' CB ' ' O ' ' A' ' 183' ' ' ARG . 77.9 ttt-85 -62.22 -44.02 97.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.482 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 68.7 m -60.34 -40.76 91.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.886 0.374 . . . . 0.0 110.316 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 53.7 tp . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 -179.844 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.573 0.225 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 68.22 -60.16 0.42 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.612 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.433 ' HB3' HH12 ' A' ' 84' ' ' ARG . 14.6 mm-40 -61.24 -33.75 74.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.378 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -58.4 -28.56 65.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.205 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.7 mt -60.91 -47.33 93.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.231 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.35 -45.1 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.433 HH12 ' HB3' ' A' ' 80' ' ' GLU . 84.1 mtt85 -55.82 -44.47 77.92 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.975 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -63.7 -45.09 91.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.017 0.437 . . . . 0.0 110.41 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.6 mt -58.17 -44.58 87.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.105 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.75 93.85 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.425 -0.51 . . . . 0.0 109.813 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -52.6 -45.56 66.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.047 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -46.59 89.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.155 0.502 . . . . 0.0 110.307 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.0 mp -62.22 -39.57 93.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.074 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.08 -41.32 78.6 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.017 0.437 . . . . 0.0 110.229 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -63.19 -51.9 64.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.111 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.91 -26.36 30.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.245 0.545 . . . . 0.0 110.342 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -73.64 -41.63 42.66 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -63.95 -42.97 97.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.775 0.322 . . . . 0.0 110.632 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 98' ' ' ASP . 51.1 m -57.09 -39.48 75.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.427 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.04 60.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.293 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 98' ' ' ASP . 67.6 t0 -169.72 42.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.418 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -131.84 -38.38 1.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.467 0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.857 179.852 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 105' ' ' LEU . 10.9 mp . . . . . 0 CA--C 1.528 0.113 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 85.6 t -64.32 -46.15 93.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.974 0.416 . . . . 0.0 110.732 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -63.38 -50.34 70.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.883 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -60.71 -32.95 80.62 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.2 tp -61.54 -46.41 90.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -54.96 -48.93 72.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.117 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.427 HD12 ' N ' ' A' ' 111' ' ' LEU . 11.2 mp -65.84 -39.2 90.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.488 178.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.34 -45.26 91.86 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.124 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.4 tp -63.65 -42.59 98.09 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.699 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 116' ' ' THR . 59.2 ttm-85 -75.2 -42.89 54.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.009 0.433 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -44.92 -17.55 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.171 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.479 ' N ' ' O ' ' A' ' 114' ' ' ARG . 16.4 m . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 66.6 t0 . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.1 mt -50.32 -38.19 40.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.451 -178.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.81 -48.95 69.36 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.26 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.3 m -60.94 -42.78 98.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.574 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.52 -47.94 78.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.346 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.91 -41.59 87.62 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.459 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -55.44 -51.41 67.01 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.941 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -53.99 -47.73 71.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.678 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.21 -43.53 94.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.442 . . . . 0.0 109.966 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.55 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -56.4 -46.88 79.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.498 -178.079 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 . . . . . 0 C--N 1.324 -0.505 0 C-N-CA 120.569 -0.452 . . . . 0.0 109.96 -179.996 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.6 ttp . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.816 0.341 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -65.33 -35.12 80.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 26.9 tptt -61.53 -47.64 84.66 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.837 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.498 ' O ' HD13 ' A' ' 149' ' ' LEU . 80.5 mm-40 -64.01 -41.75 97.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.825 0.345 . . . . 0.0 110.569 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.526 ' O ' HG23 ' A' ' 150' ' ' VAL . 31.2 ttpt -58.29 -42.24 86.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.45 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.1 m -60.19 -46.84 88.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.709 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.2 mtm -64.59 -41.53 96.19 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.749 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 145' ' ' GLU . 7.7 mp -63.99 -41.1 97.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.727 0.299 . . . . 0.0 110.626 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 146' ' ' LYS . 53.8 t -60.83 -45.06 98.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.476 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.2 tp -61.39 -45.41 94.49 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.463 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.94 -37.0 86.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.639 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.87 -41.92 99.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.417 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.02 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.18 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.42 ' O ' HG23 ' A' ' 159' ' ' VAL . 91.4 mt -61.39 -43.31 99.08 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.023 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -71.65 -46.62 58.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.47 179.206 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.97 -37.46 87.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.507 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -61.07 -44.55 97.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.596 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 155' ' ' LEU . 53.1 t -60.17 -48.81 86.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.323 -179.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.14 -38.54 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.952 0.406 . . . . 0.0 110.955 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' SER . . . . . 0.564 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 29.4 t -72.04 -165.57 0.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.416 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 162' ' ' HIS . . . . . 0.564 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.9 m-70 167.38 89.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.119 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.1 p -123.74 152.98 66.64 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.584 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -68.03 156.36 66.14 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.489 2.126 . . . . 0.0 111.7 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 83.8 p . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.624 -179.953 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.539 HD22 ' N ' ' A' ' 167' ' ' LEU . 3.9 mm? . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.892 0.377 . . . . 0.0 110.519 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -61.87 -38.02 86.72 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.42 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -62.72 -46.89 85.99 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.557 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.0 t -66.63 -48.92 78.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.049 0.452 . . . . 0.0 110.143 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -56.23 -39.46 72.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.628 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -61.56 -41.37 97.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.687 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 99.3 m -59.54 -46.59 88.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.551 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 81.7 m -57.88 -43.71 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.029 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.9 t -56.67 -43.79 79.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.721 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.771 179.703 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.41 HD12 ' N ' ' A' ' 182' ' ' LEU . 11.1 mp . . . . . 0 C--O 1.221 -0.403 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 183' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 187' ' ' ARG . 61.0 ttt85 -51.51 -43.28 62.2 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.498 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -63.44 -52.3 62.04 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.749 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -68.5 -41.0 80.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.833 0.349 . . . . 0.0 111.282 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 189' ' ' LEU . 40.7 t -62.76 -45.77 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.552 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 187' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 183' ' ' ARG . 64.5 ttm-85 -60.56 -52.54 64.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.42 -178.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 79.8 p -63.72 -38.95 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.726 0.298 . . . . 0.0 110.616 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.443 ' O ' ' O ' ' A' ' 186' ' ' VAL . 54.7 tp . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.308 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.817 0.342 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.38 -9.47 56.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.18 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -71.34 -37.0 71.74 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.434 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.35 -51.48 69.32 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.281 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.406 HG23 ' N ' ' A' ' 83' ' ' ILE . 12.9 tt -65.18 -41.3 91.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.094 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.406 ' N ' HG23 ' A' ' 82' ' ' ILE . 73.6 mt -63.09 -42.35 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.171 178.371 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -55.72 -48.77 74.6 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.623 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -60.84 -41.79 96.53 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.515 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.01 -44.63 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.897 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.85 -46.28 78.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.803 0.335 . . . . 0.0 110.35 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 95.2 mtm-85 -56.25 -43.52 78.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.649 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -64.12 -45.54 88.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.085 0.469 . . . . 0.0 110.475 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.05 -35.69 80.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.204 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.51 82.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.712 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.95 -52.52 55.84 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.529 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.73 -25.93 31.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.758 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.546 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -84.44 -35.34 14.42 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.318 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -65.15 -47.15 78.07 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.537 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 29.8 t -166.0 152.63 9.54 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.725 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.7 tpt -154.93 128.72 8.67 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.144 0.497 . . . . 0.0 110.602 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.563 ' O ' ' N ' ' A' ' 100' ' ' SER . 89.7 m-20 40.09 65.04 0.79 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.226 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -38.02 -24.07 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.188 0.518 . . . . 0.0 110.598 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 98' ' ' ASP . 26.8 t . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.628 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.443 ' N ' ' CD2' ' A' ' 105' ' ' LEU . 4.0 mm? . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.56 0.219 . . . . 0.0 110.63 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 107' ' ' ASN . 12.7 p -61.17 -43.77 97.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.643 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.56 ' N ' HG13 ' A' ' 106' ' ' VAL . 50.2 t-20 -65.84 -36.4 83.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.0 110.489 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.99 -26.04 4.18 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.516 ' N ' HD22 ' A' ' 109' ' ' LEU . 4.0 mm? -62.66 -43.48 98.69 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.022 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.06 -40.09 69.95 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.893 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 50.6 tp -66.69 -41.47 88.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.708 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -54.68 -42.78 71.83 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.31 -40.44 97.34 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.435 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -74.06 -28.12 61.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.421 . . . . 0.0 110.596 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -63.57 -41.88 98.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.696 -179.848 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 25.6 p-10 . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 111.331 0.123 . . . . 0.0 111.331 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.544 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 51.9 mt -67.1 -34.24 77.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 110.812 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -39.39 66.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.1 m -62.03 -47.35 85.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.433 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.72 -43.59 94.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.946 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.28 -41.7 98.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 110.476 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -60.31 -46.58 89.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.358 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.46 -52.65 63.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.65 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.24 -49.49 73.94 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.157 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 56.7 tp -57.19 -38.08 73.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.274 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 . . . . . 0 C--N 1.323 -0.577 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.261 179.797 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 38.8 ttm . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.837 0.351 . . . . 0.0 110.452 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.407 ' O ' ' OG1' ' A' ' 147' ' ' THR . 43.5 tp10 -67.16 -35.07 78.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.73 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.58 -31.58 69.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.725 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -69.05 -47.95 64.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.148 0.499 . . . . 0.0 110.815 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.419 ' O ' HG23 ' A' ' 150' ' ' VAL . 53.8 mtmt -67.24 -38.13 84.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.721 178.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 10.2 m -58.55 -43.27 89.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.113 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.5 mtt -61.41 -46.4 90.29 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.04 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.6 mp -65.71 -45.85 81.21 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 119.622 -0.831 . . . . 0.0 110.466 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 146' ' ' LYS . 64.9 t -60.53 -42.54 91.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 -179.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 27.1 mt -60.01 -42.59 94.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.036 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.73 -43.74 95.62 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.174 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.567 HD11 ' NZ ' ' A' ' 157' ' ' LYS . 38.0 tp -60.72 -42.31 97.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.0 mt -61.25 -43.43 98.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.049 0.452 . . . . 0.0 110.158 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.422 ' O ' HG23 ' A' ' 159' ' ' VAL . 88.9 mt -63.41 -44.09 95.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.054 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.23 -35.46 76.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' LYS . . . . . 0.567 ' NZ ' HD11 ' A' ' 153' ' ' LEU . 26.8 mmtm -60.27 -48.99 79.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.044 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -67.31 -40.75 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.022 0.439 . . . . 0.0 110.897 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 155' ' ' LEU . 71.1 t -67.71 -44.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.535 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.75 96.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' SER . . . . . 0.421 ' O ' ' O ' ' A' ' 157' ' ' LYS . 25.8 t -173.51 179.2 2.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.351 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -128.42 143.94 51.07 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.063 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.4 p -78.36 150.05 76.37 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.607 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.48 156.34 61.67 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.26 1.974 . . . . 0.0 112.012 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 72.3 m . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.381 179.596 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.549 HD12 ' N ' ' A' ' 167' ' ' LEU . 9.0 mp . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.022 0.439 . . . . 0.0 110.088 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.45 -42.64 99.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.14 -45.79 86.96 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.996 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.69 -44.53 96.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.467 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.88 -41.9 92.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.284 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.96 -48.71 80.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.612 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.8 m -59.3 -46.73 87.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.078 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.6 m -52.94 -43.11 66.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.986 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.4 t -61.04 -44.98 99.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.366 179.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 . . . . . 0 C--N 1.331 -0.236 0 CA-C-O 121.024 0.44 . . . . 0.0 110.464 179.295 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 N--CA 1.462 0.137 0 CA-C-O 120.816 0.341 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 183' ' ' ARG . . . . . 0.421 ' HD3' ' H ' ' A' ' 183' ' ' ARG . 0.7 OUTLIER -61.47 -45.65 93.37 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 18.9 m -58.0 -46.64 84.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.855 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -54.19 -41.97 69.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.61 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 70.9 t -60.3 -50.83 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.284 -0.567 . . . . 0.0 110.246 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -67.85 -33.83 75.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.274 0.559 . . . . 0.0 110.475 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 35.2 t -58.04 -44.08 87.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.172 -179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 80' ' ' GLU . 60.5 m . . . . . 0 CA--C 1.52 -0.183 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 68.0 -38.43 0.36 Allowed 'General case' 0 CA--C 1.528 0.115 0 O-C-N 123.495 0.497 . . . . 0.0 110.738 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.52 ' H ' ' C ' ' A' ' 78' ' ' SER . 16.5 mm-40 -64.81 -33.74 76.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.276 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -58.22 -30.79 66.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.342 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.13 -45.95 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.874 0.369 . . . . 0.0 110.187 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.12 -42.1 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.507 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -56.49 -44.57 80.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.478 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -64.67 -41.53 96.02 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 110.528 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 80.4 mt -60.14 -41.73 87.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.208 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.141 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 75.8 mtp85 -54.63 -45.74 73.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.431 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -63.69 -49.93 71.2 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.387 0.613 . . . . 0.0 110.232 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.1 -32.56 73.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.903 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -65.58 -36.33 83.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.264 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -63.56 -52.04 62.79 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.229 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.02 -26.37 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.415 0.626 . . . . 0.0 110.715 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.21 -38.56 10.95 Favored Glycine 0 N--CA 1.466 0.644 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.66 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.6 t70 -78.75 -44.07 24.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.415 0.15 . . . . 0.0 111.045 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 5.0 m -77.02 121.47 23.56 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.086 0.469 . . . . 0.0 110.809 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 94.0 mmm -140.38 19.45 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -63.23 -38.92 93.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.725 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -61.51 -40.41 94.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.651 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 CA--C 1.516 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 -179.951 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 105' ' ' LEU . 10.8 mp . . . . . 0 C--O 1.226 -0.176 0 CA-C-O 120.745 0.307 . . . . 0.0 110.728 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.505 HG13 ' N ' ' A' ' 107' ' ' ASN . 9.9 p -55.51 -43.34 72.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.98 0.419 . . . . 0.0 110.525 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.505 ' N ' HG13 ' A' ' 106' ' ' VAL . 65.8 t30 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.633 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -60.34 -34.81 86.48 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 17.2 mt -61.55 -42.3 98.63 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.481 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.51 -39.16 70.14 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.371 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.2 mt -67.78 -38.19 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.848 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -59.12 -40.6 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.151 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.554 ' O ' HG22 ' A' ' 116' ' ' THR . 4.2 mm? -63.13 -42.56 99.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.923 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 67.7 ttt-85 -78.43 -42.1 31.04 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.038 0.447 . . . . 0.0 110.677 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -48.78 -31.78 7.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.833 -178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.554 HG22 ' O ' ' A' ' 113' ' ' LEU . 1.4 t . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.585 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 42.8 t0 . . . . . 0 N--CA 1.449 -0.494 0 CA-C-O 120.367 0.127 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 51.5 mt -66.75 -34.99 79.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.835 0.35 . . . . 0.0 111.019 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -36.12 63.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.797 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 72.4 m -61.23 -46.76 89.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.446 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.53 89.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.581 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.37 -42.88 99.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.638 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -62.61 -48.94 77.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.668 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -58.86 -43.14 90.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.425 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 46.2 tp -63.57 -46.92 83.68 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.325 -0.55 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.596 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.43 -37.75 76.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.294 0.569 . . . . 0.0 110.59 -178.001 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 . . . . . 0 C--N 1.317 -0.809 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.416 -179.94 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 38.1 ttm . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.905 0.383 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -68.38 -33.9 75.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -61.74 -34.83 76.52 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -69.87 -38.91 76.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.575 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -68.32 -39.98 81.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.964 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 85.4 m -60.12 -43.01 95.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.312 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.1 tpp -60.27 -46.82 88.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.227 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.02 -46.5 71.05 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.5 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 67.9 t -62.26 -41.89 93.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.402 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 47.9 tp -58.28 -45.79 87.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.12 -39.78 93.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.976 0.417 . . . . 0.0 110.266 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 44.3 tp -60.39 -41.22 93.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.83 -44.43 96.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.116 0.484 . . . . 0.0 110.068 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.01 -45.4 92.52 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.213 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.07 -35.81 78.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.549 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -60.31 -47.45 85.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.489 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.23 -39.23 94.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.065 0.46 . . . . 0.0 110.428 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 78.0 t -68.35 -43.17 84.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.557 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.25 99.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.333 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 46.3 t -156.24 154.74 31.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 110.548 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -81.96 -35.8 28.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.611 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 m 64.95 84.38 0.18 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.224 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.97 147.61 62.4 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 122.725 2.283 . . . . 0.0 112.232 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.469 -179.953 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 61.3 mt . . . . . 0 N--CA 1.462 0.154 0 CA-C-O 121.198 0.523 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -60.84 -43.93 97.64 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.372 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -70.01 -43.88 70.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.036 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.05 -46.73 95.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.603 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -65.01 -37.06 86.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.727 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -59.69 -49.42 77.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.302 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.3 m -59.58 -46.13 89.85 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.863 0.363 . . . . 0.0 110.371 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.0 m -53.22 -43.8 67.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.44 -43.17 97.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.772 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 120.944 0.402 . . . . 0.0 110.842 179.947 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.491 ' O ' HG23 ' A' ' 186' ' ' VAL . 10.9 mp . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 120.552 0.215 . . . . 0.0 110.448 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -50.74 -45.03 58.59 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.128 -177.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.6 m -62.32 -50.41 71.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.14 0.495 . . . . 0.0 110.456 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -65.35 -36.94 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.729 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 182' ' ' LEU . 40.4 t -61.46 -46.29 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.493 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -60.61 -53.61 55.39 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.146 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 47.9 m -58.71 -40.19 82.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.872 0.368 . . . . 0.0 110.432 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 25.4 mt . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.59 179.982 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.523 -0.082 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -120.82 -46.94 2.32 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.545 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.63 -41.59 88.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.748 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.37 -39.36 94.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.0 mm -61.36 -44.16 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.232 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.0 mt -61.9 -41.74 91.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.179 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -59.88 -40.39 88.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.76 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.422 ' HA ' ' HE ' ' A' ' 88' ' ' ARG . 59.9 t-20 -66.65 -52.46 44.75 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.807 0.337 . . . . 0.0 110.943 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.9 -38.31 72.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.017 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.99 -51.75 68.71 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.226 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.422 ' HE ' ' HA ' ' A' ' 85' ' ' ASN . 87.9 mtm180 -54.32 -48.95 70.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.44 -179.185 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -66.94 -45.16 78.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.398 0.618 . . . . 0.0 110.245 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.3 tt -59.65 -40.66 88.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.273 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.89 -46.92 86.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.382 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.03 -52.18 65.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.27 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.5 t -74.51 -25.99 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.429 0.633 . . . . 0.0 110.719 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.534 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.33 -24.1 76.88 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.862 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.496 ' O ' ' CB ' ' A' ' 96' ' ' SER . 99.6 m-20 -72.58 -46.82 52.45 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.921 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.496 ' CB ' ' O ' ' A' ' 95' ' ' ASP . 1.8 m 158.23 -79.54 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.64 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.438 ' O ' ' O ' ' A' ' 96' ' ' SER . 24.7 mmm 57.87 121.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.453 -179.504 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 53.21 21.47 2.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.545 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -138.83 -32.49 0.68 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.481 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.955 179.877 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.597 HD12 ' N ' ' A' ' 105' ' ' LEU . 9.1 mp . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 120.867 0.365 . . . . 0.0 110.708 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 107' ' ' ASN . 9.1 p -54.86 -39.01 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.188 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.531 ' OD1' ' N ' ' A' ' 108' ' ' GLY . 45.0 p-10 -58.63 -29.73 66.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.341 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.531 ' N ' ' OD1' ' A' ' 107' ' ' ASN . . . -69.71 -50.38 30.9 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 109' ' ' LEU . 8.7 mp -63.0 -42.38 99.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.929 0.395 . . . . 0.0 110.434 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.94 -49.04 76.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.629 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 72.2 mt -71.01 -44.04 66.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.919 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -57.63 -41.2 80.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.12 -43.9 97.82 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 119.809 -0.756 . . . . 0.0 110.142 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 84.2 mtt85 -71.87 -28.71 63.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.047 0.451 . . . . 0.0 110.268 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -62.87 -38.09 89.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.738 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 -179.356 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.9 t0 . . . . . 0 C--O 1.232 0.134 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.2 mt -51.24 -33.43 28.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -49.36 69.73 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.435 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.4 m -61.69 -43.15 99.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.99 78.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.429 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -59.49 -41.64 90.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.56 -50.19 72.31 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.163 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -55.33 -45.54 76.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.449 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.56 -47.82 82.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.019 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.548 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -57.39 -41.23 79.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.7 -177.678 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.126 -179.649 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 18.3 tpp . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.665 0.269 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.81 -37.25 86.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.842 0.353 . . . . 0.0 110.756 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -60.54 -38.17 83.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.09 0.471 . . . . 0.0 111.156 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -75.96 -34.54 59.83 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.621 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.554 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 18.8 m -62.1 -44.11 97.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.536 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 19.1 mtm -61.67 -44.03 97.74 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.5 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.8 mt -67.91 -49.57 61.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 78.2 t -62.56 -43.2 98.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.378 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 49.8 tp -58.98 -45.46 90.54 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.439 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.03 -42.53 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.043 0.449 . . . . 0.0 110.275 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 24.2 tp -59.16 -41.85 89.36 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.115 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.4 -44.32 97.35 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.545 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.26 -46.61 82.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.356 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.26 -43.98 80.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.102 0.477 . . . . 0.0 110.43 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.56 -38.7 91.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.128 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -60.52 -41.27 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.321 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 88.5 t -66.38 -45.11 90.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.559 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.15 -35.34 80.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.05 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 35.9 p -157.73 160.93 38.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.198 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' HIS . . . . . 0.461 ' O ' ' O ' ' A' ' 163' ' ' THR . 55.2 m80 -128.39 50.05 2.12 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.369 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.461 ' O ' ' O ' ' A' ' 162' ' ' HIS . 14.4 p 56.95 147.84 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.0 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.433 ' O ' ' CB ' ' A' ' 165' ' ' SER . 56.8 Cg_endo -70.74 -91.01 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.64 0 C-N-CA 122.153 1.902 . . . . 0.0 111.75 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.6 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 121.112 0.482 . . . . 0.0 110.348 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.581 HD22 ' N ' ' A' ' 167' ' ' LEU . 3.9 mm? . . . . . 0 CA--C 1.523 -0.09 0 CA-C-O 121.058 0.456 . . . . 0.0 110.806 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.09 -43.81 73.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.876 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -66.76 -46.93 73.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.028 0.442 . . . . 0.0 110.913 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.5 -44.27 94.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.421 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 171' ' ' PHE . . . . . 0.4 ' O ' HG23 ' A' ' 175' ' ' VAL . 81.6 t80 -61.49 -37.62 84.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.486 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.68 -49.71 76.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.411 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.2 m -59.13 -42.51 90.81 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.53 -42.47 87.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.224 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 171' ' ' PHE . 69.6 t -61.76 -37.99 79.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.471 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 120.867 0.365 . . . . 0.0 110.359 -179.609 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 5.1 tp . . . . . 0 CA--C 1.523 -0.082 0 CA-C-O 120.953 0.406 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -51.81 -30.84 24.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.224 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 75.3 m -59.32 -51.42 70.01 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.836 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -70.6 -43.77 68.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.067 0.461 . . . . 0.0 110.889 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 69.6 t -64.35 -43.9 97.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.572 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.57 -45.2 92.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.562 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 37.6 m -59.22 -31.95 69.51 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.351 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.569 HD13 ' O ' ' A' ' 189' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.47 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.181 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.458 -0.059 0 CA-C-O 120.523 0.202 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.581 ' O ' HG22 ' A' ' 82' ' ' ILE . 37.4 tt0 70.88 -49.04 0.67 Allowed 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.463 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -69.36 -33.78 73.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.932 0.396 . . . . 0.0 110.871 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 81' ' ' ASP . 60.0 t0 -47.66 -32.0 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.634 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.581 HG22 ' O ' ' A' ' 79' ' ' GLN . 15.2 tt -61.39 -43.81 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.428 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.484 ' N ' HG23 ' A' ' 82' ' ' ILE . 96.6 mt -65.01 -43.54 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.138 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -50.7 -53.68 29.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.192 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -61.09 -42.08 97.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.598 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.6 mt -60.32 -52.02 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.064 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.24 93.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.194 0.521 . . . . 0.0 110.294 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -54.96 -45.57 74.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.196 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -65.22 -39.55 92.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mt -66.68 -37.97 85.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.422 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.82 -47.74 79.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.173 0.511 . . . . 0.0 110.19 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -62.12 -52.23 64.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -65.5 -27.49 41.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.355 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -64.1 -32.95 85.9 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.41 -44.4 92.86 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.578 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.4 p -161.62 89.54 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.917 0.389 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.5 mtm -60.94 -49.75 76.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.27 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.615 ' C ' ' H ' ' A' ' 100' ' ' SER . 67.8 t0 -176.85 123.81 0.15 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.312 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.6 mtm180 -55.41 1.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.615 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.6 t . . . . . 0 N--CA 1.451 -0.379 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.601 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.688 HD12 ' N ' ' A' ' 105' ' ' LEU . 7.5 mp . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.042 0.449 . . . . 0.0 110.283 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 90.9 t -50.47 -41.7 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.946 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -57.72 -48.31 79.96 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.284 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.49 -51.1 58.65 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.92 -41.2 99.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.005 0.431 . . . . 0.0 110.121 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.69 -39.96 78.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.066 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.55 -44.29 96.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.516 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -68.01 -48.22 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.567 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 tp -61.35 -23.06 65.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.627 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -74.13 -43.99 55.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.795 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -63.23 -41.55 99.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.922 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.348 179.972 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 120.436 0.16 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.552 ' N ' HD22 ' A' ' 127' ' ' LEU . 4.0 mm? -71.63 -43.45 66.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.041 0.448 . . . . 0.0 110.855 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.6 70.18 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.445 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 96.7 m -57.47 -51.49 69.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.356 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.21 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.04 0.448 . . . . 0.0 110.604 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.68 -47.02 82.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.411 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -56.2 -41.84 76.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.284 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -58.24 -45.46 87.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.8 -47.21 75.86 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.231 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.37 -33.76 76.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.628 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.114 179.958 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.8 mtm . . . . . 0 N--CA 1.463 0.196 0 CA-C-O 120.817 0.342 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.467 ' CG ' ' N ' ' A' ' 144' ' ' LYS . 10.1 pt-20 -51.3 -46.35 62.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.424 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' LYS . . . . . 0.467 ' N ' ' CG ' ' A' ' 143' ' ' GLU . 88.1 tttt -62.88 -48.56 78.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.258 0.551 . . . . 0.0 109.985 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.82 -46.8 77.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.865 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 33.7 mtpt -65.98 -39.47 90.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.783 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 76.8 m -59.94 -47.8 84.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.749 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 74.1 mtm -61.4 -42.12 98.22 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.533 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.54 -43.33 85.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.809 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 64.6 t -67.97 -50.51 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.391 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.87 -44.2 96.74 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.001 0.429 . . . . 0.0 110.773 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.51 -37.74 88.48 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.19 -40.65 96.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.508 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.7 -49.46 77.42 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.789 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 155' ' ' LEU . 4.1 mm? -65.32 -43.4 91.13 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.715 179.233 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.43 -42.9 82.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.343 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -67.52 -36.73 81.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.344 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.13 -41.97 97.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.551 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 75.5 t -63.62 -45.35 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.681 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -59.62 -51.15 71.06 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.119 -0.633 . . . . 0.0 110.01 -179.34 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 161' ' ' SER . . . . . 0.44 ' O ' ' C ' ' A' ' 162' ' ' HIS . 17.5 t 35.02 -120.55 0.11 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.296 0.373 . . . . 0.0 110.631 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' HIS . . . . . 0.44 ' C ' ' O ' ' A' ' 161' ' ' SER . 78.9 m-70 31.75 78.78 0.03 OUTLIER 'General case' 0 C--N 1.341 0.217 0 O-C-N 123.216 0.322 . . . . 0.0 111.555 178.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.547 HG21 ' HE ' ' A' ' 168' ' ' ARG . 17.9 m -129.61 80.58 71.51 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.237 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.97 149.88 67.78 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.904 2.403 . . . . 0.0 111.959 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 165' ' ' SER . . . . . 0.474 ' O ' ' N ' ' A' ' 167' ' ' LEU . 13.6 p . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.763 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.474 ' N ' ' O ' ' A' ' 165' ' ' SER . 51.5 tp . . . . . 0 N--CA 1.455 -0.224 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.547 ' HE ' HG21 ' A' ' 163' ' ' THR . 99.8 mtt180 -66.59 -37.88 85.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.691 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.52 -47.0 88.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.72 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 80.8 t -68.37 -43.15 84.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.298 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -58.4 -46.68 85.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.691 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 31.2 m80 -65.03 -48.81 72.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.943 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.97 -45.92 89.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.4 m -53.35 -44.82 68.83 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.152 0.501 . . . . 0.0 110.214 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.73 -43.13 90.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.421 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 -179.332 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.539 HD12 ' N ' ' A' ' 182' ' ' LEU . 9.7 mp . . . . . 0 CA--C 1.527 0.061 0 CA-C-O 120.803 0.335 . . . . 0.0 110.518 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -53.03 -32.69 48.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.613 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 184' ' ' THR . . . . . 0.413 ' HA ' ' HE ' ' A' ' 187' ' ' ARG . 20.2 m -57.22 -47.67 80.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.962 0.411 . . . . 0.0 110.6 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -67.55 -35.58 79.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.531 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 88.2 t -64.77 -43.9 96.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.549 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 187' ' ' ARG . . . . . 0.413 ' HE ' ' HA ' ' A' ' 184' ' ' THR . 87.8 mtm180 -60.34 -48.99 79.38 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.552 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 67.0 m -61.43 -42.36 98.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.851 0.358 . . . . 0.0 110.637 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 4.9 tp . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.578 -179.85 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.1 t . . . . . 0 N--CA 1.46 0.05 0 CA-C-O 120.775 0.321 . . . . 0.0 110.654 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -58.61 -8.39 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.567 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -62.23 -36.77 83.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.396 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -60.21 -48.29 82.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.432 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.3 mt -66.44 -43.68 90.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.447 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.31 -43.63 98.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.238 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 78.6 ttt-85 -56.09 -48.04 76.87 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -60.79 -42.74 98.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.038 0.447 . . . . 0.0 110.658 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 82.9 mt -60.52 -45.38 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.05 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.64 -39.04 93.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.119 0.485 . . . . 0.0 110.197 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -56.69 -48.62 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.906 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.24 -45.85 89.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.246 0.546 . . . . 0.0 110.49 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.522 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.1 mt -63.8 -39.41 94.18 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.462 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.479 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.39 -46.9 76.54 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.417 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.6 tp60 -64.53 -52.38 58.02 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.163 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.7 t -65.32 -25.96 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.392 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.16 -32.38 14.33 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.404 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.479 ' N ' ' O ' ' A' ' 91' ' ' ALA . 64.7 t0 -70.69 -46.85 62.39 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.999 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.525 ' C ' ' H ' ' A' ' 98' ' ' ASP . 57.4 m -51.34 -105.93 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.815 0.34 . . . . 0.0 110.991 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 mmt 55.38 4.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.213 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.525 ' H ' ' C ' ' A' ' 96' ' ' SER . 98.1 m-20 -76.45 -67.11 0.72 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.344 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -90.09 -30.39 17.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.632 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.9 m . . . . . 0 CA--C 1.518 -0.273 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.261 -179.931 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.618 HD22 ' N ' ' A' ' 105' ' ' LEU . 3.7 mm? . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 120.946 0.403 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.61 HG13 ' N ' ' A' ' 107' ' ' ASN . 14.5 p -58.96 -48.44 86.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.405 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.61 ' N ' HG13 ' A' ' 106' ' ' VAL . 36.3 t30 -57.46 -34.37 68.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.361 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.79 -39.66 95.27 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 51.3 tp -60.43 -42.05 95.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 110.695 -179.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.82 -48.8 80.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.149 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.06 -42.26 76.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.245 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -50.84 -37.54 43.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.79 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 64.6 mt -62.33 -43.28 99.2 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.199 -0.6 . . . . 0.0 109.992 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -55.65 -41.95 74.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.0 110.03 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -63.2 -39.78 95.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.387 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 45.0 p . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.755 -179.734 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.8 t0 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 120.823 0.344 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.892 HD22 ' N ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -49.23 -28.69 4.83 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.732 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.892 ' N ' HD22 ' A' ' 127' ' ' LEU . . . -56.58 -39.58 73.75 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.14 0.495 . . . . 0.0 109.971 -178.24 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 88.0 m -61.79 -42.37 98.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.697 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.15 79.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.227 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -58.93 -44.91 91.45 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.385 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -67.06 -45.96 75.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.067 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -64.97 -37.0 86.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.78 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.6 tp -59.28 -54.49 46.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.362 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.77 -38.5 90.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.719 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 . . . . . 0 C--N 1.321 -0.655 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.435 -179.207 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 142' ' ' MET . . . . . 0.459 ' CG ' ' N ' ' A' ' 143' ' ' GLU . 12.8 ptm . . . . . 0 N--CA 1.454 -0.251 0 CA-C-O 120.94 0.4 . . . . 0.0 110.384 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 142' ' ' MET . 81.4 tt0 -66.64 -42.87 86.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.021 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.59 -29.8 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.684 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.55 -50.31 63.58 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.605 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.443 ' O ' HG23 ' A' ' 150' ' ' VAL . 20.2 ptmt -72.85 -30.16 63.78 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.827 -0.545 . . . . 0.0 110.819 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 68.4 m -60.24 -46.22 90.52 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.314 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 66.4 mtt -64.91 -46.58 81.1 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.581 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.5 mp -66.09 -47.29 74.73 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.032 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 146' ' ' LYS . 57.0 t -62.51 -43.66 98.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.038 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.3 tp -53.12 -46.3 68.71 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.2 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.33 -35.98 82.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tp -59.25 -44.83 92.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.536 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.83 -44.41 96.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.048 0.451 . . . . 0.0 110.143 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.3 -43.74 90.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.055 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.69 -44.99 69.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.686 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' LYS . . . . . 0.427 ' O ' ' O ' ' A' ' 161' ' ' SER . 25.9 tptp -61.99 -40.59 96.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.572 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -62.39 -45.47 93.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.37 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.75 -43.99 82.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.687 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.94 -37.44 87.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.179 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 157' ' ' LYS . 41.1 t -172.36 176.84 3.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.275 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -128.2 142.67 51.1 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.829 0.347 . . . . 0.0 110.124 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.531 ' CB ' HH21 ' A' ' 168' ' ' ARG . 1.1 p -84.89 153.41 60.44 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.586 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.22 -162.38 0.1 OUTLIER 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 122.592 2.195 . . . . 0.0 111.83 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 61.6 p . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.478 -179.867 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 55.1 mt . . . . . 0 C--O 1.232 0.149 0 CA-C-O 121.017 0.437 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.531 HH21 ' CB ' ' A' ' 163' ' ' THR . 63.1 ttm-85 -60.06 -45.59 92.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.24 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.79 -46.03 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.935 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 75.6 t -63.22 -45.3 98.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.438 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -61.12 -38.23 85.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.095 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -59.75 -46.83 87.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.591 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.7 m -61.24 -46.99 88.1 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.6 m -52.59 -43.71 65.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.446 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 72.1 t -62.69 -43.41 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.292 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 176' ' ' ASN . . . . . 0.444 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 54.7 t-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 121.292 0.568 . . . . 0.0 110.649 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 186' ' ' VAL . 10.9 mp . . . . . 0 N--CA 1.451 -0.417 0 CA-C-O 120.595 0.236 . . . . 0.0 110.626 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 90.1 mtm-85 -51.75 -49.71 62.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.342 -178.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 96.7 m -66.78 -49.65 65.21 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.106 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -62.3 -43.89 97.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.704 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 182' ' ' LEU . 46.8 t -59.59 -42.97 89.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.005 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -56.2 -53.88 51.91 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.797 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 9.9 p -62.83 -41.47 99.35 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.591 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.504 HD22 ' N ' ' A' ' 189' ' ' LEU . 4.2 mm? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.345 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.657 0.265 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -172.85 -73.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.36 -35.55 81.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.187 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -61.61 -41.52 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.493 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.429 ' O ' HD13 ' A' ' 86' ' ' ILE . 22.1 mm -62.06 -49.06 85.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.104 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.6 -42.53 94.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.167 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -51.46 -54.59 25.34 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.882 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -53.89 -44.02 70.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.944 0.402 . . . . 0.0 110.912 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 82' ' ' ILE . 1.5 mp -63.4 -49.88 80.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 120.288 -0.565 . . . . 0.0 109.511 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.483 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -60.37 -37.69 81.53 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.948 -179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -58.56 -47.19 85.05 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.561 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -68.88 -46.98 67.0 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.223 0.535 . . . . 0.0 110.854 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.71 -35.47 78.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.771 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.483 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -64.1 -42.74 96.78 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -64.05 -52.72 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.509 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.3 p -73.67 -27.09 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.216 0.531 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -78.37 -35.8 32.36 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.74 -47.05 82.58 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.788 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.9 m -163.48 143.59 8.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.34 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 ttm -72.41 98.44 2.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.286 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.452 ' O ' ' CB ' ' A' ' 99' ' ' ARG . 66.4 t0 41.75 42.59 2.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.317 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.452 ' CB ' ' O ' ' A' ' 98' ' ' ASP . 7.9 tpt180 80.07 -74.18 0.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.307 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.7 p . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.749 -179.832 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 59.6 mt . . . . . 0 CA--C 1.523 -0.096 0 CA-C-O 120.766 0.317 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 99.3 t -61.21 -45.1 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.215 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -62.7 -41.4 99.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.92 -21.94 11.2 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.7 mt -61.53 -40.05 93.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.77 0.319 . . . . 0.0 110.579 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.14 -44.79 44.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.679 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.545 ' N ' HD22 ' A' ' 111' ' ' LEU . 3.9 mm? -65.67 -34.73 78.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.928 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -69.03 -47.16 66.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.388 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.99 -42.92 97.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.225 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -63.03 -46.2 88.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.195 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -70.81 -40.63 72.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.464 0.225 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.4 -179.707 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 64.4 t0 . . . . . 0 CA--C 1.519 -0.213 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.0 -40.46 91.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 120.796 0.332 . . . . 0.0 111.149 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -38.72 66.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.494 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 55.8 m -72.91 -42.77 63.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.75 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.02 87.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.079 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.9 -47.12 86.4 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.83 0.348 . . . . 0.0 110.716 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -55.07 -41.12 71.09 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.18 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -67.92 -38.47 82.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.661 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.74 -54.46 46.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.595 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.495 ' N ' HD12 ' A' ' 135' ' ' LEU . 8.2 mp -65.32 -40.26 93.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.012 0.434 . . . . 0.0 110.614 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.341 179.494 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 120.858 0.361 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -63.61 -34.81 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.785 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -60.9 -38.09 84.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.006 0.431 . . . . 0.0 110.241 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -62.04 -45.55 93.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.424 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.489 ' O ' HG23 ' A' ' 150' ' ' VAL . 99.1 mttt -66.92 -32.94 74.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 19.3 m -58.92 -45.46 90.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.259 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.7 mtt -63.16 -45.98 89.32 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.658 -0.417 . . . . 0.0 109.954 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.95 -42.65 80.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 146' ' ' LYS . 42.9 t -62.71 -43.17 98.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.285 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.27 -47.49 85.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.429 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.99 87.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.181 0.515 . . . . 0.0 109.728 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 5.6 tp -59.08 -40.77 86.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.168 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 29.1 mt -61.22 -44.73 96.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.966 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.7 -46.45 82.32 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.181 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.18 96.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.15 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -63.38 -38.94 93.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.301 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -58.17 -42.32 85.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.717 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.5 t -65.59 -46.07 90.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.281 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -69.1 -32.89 72.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.047 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 161' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 11.3 t -31.39 94.7 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.124 0.488 . . . . 0.0 110.996 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 162' ' ' HIS . . . . . 0.511 ' CG ' ' O ' ' A' ' 161' ' ' SER . 89.2 m-70 -159.83 41.91 0.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.151 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.544 ' N ' ' CD ' ' A' ' 164' ' ' PRO . 0.5 OUTLIER -128.25 48.12 3.26 Favored Pre-proline 0 N--CA 1.466 0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.351 179.507 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 163' ' ' THR . 36.4 Cg_endo -66.1 140.71 60.73 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.503 2.136 . . . . 0.0 111.738 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 165' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.4 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.432 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.598 HD12 ' C ' ' A' ' 167' ' ' LEU . 1.6 pp . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 120.983 0.42 . . . . 0.0 110.466 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -62.09 -47.09 86.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 169' ' ' ASP . . . . . 0.4 ' O ' ' OD1' ' A' ' 169' ' ' ASP . 66.7 t0 -66.71 -38.71 87.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.54 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 84.8 t -61.95 -46.51 96.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.586 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -61.21 -41.3 96.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.837 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.95 -49.71 76.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.501 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 85.2 m -60.07 -42.47 94.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.547 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.2 m -56.31 -43.19 78.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.435 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.0 t -61.33 -43.13 96.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.542 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.797 179.839 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 53.9 tp . . . . . 0 N--CA 1.454 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.739 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -56.73 -32.78 65.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.415 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 69.3 m -61.0 -49.07 78.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -68.91 -42.22 77.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.027 0.441 . . . . 0.0 110.316 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.98 -42.69 97.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.682 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -58.95 -44.73 91.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.298 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.3 t -61.23 -44.48 97.2 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.775 0.321 . . . . 0.0 110.518 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 50.8 tp . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.55 -179.704 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.0 m . . . . . 0 N--CA 1.465 0.31 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? 70.92 -56.52 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -65.22 -33.82 76.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.0 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -58.48 -45.4 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.525 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.46 -43.77 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.408 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.7 mt -62.41 -43.36 98.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -53.46 -53.18 55.09 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -58.1 -42.37 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.699 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.54 -51.59 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.011 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -61.81 -38.2 87.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.338 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -55.96 -47.51 77.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.607 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -66.23 -45.17 81.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.507 . . . . 0.0 110.826 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.451 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.3 mt -68.44 -33.6 74.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.471 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.46 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -58.78 -46.48 87.45 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.132 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.32 -51.99 60.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.077 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.39 -26.16 38.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.17 -22.96 42.59 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -63.13 -43.85 97.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.703 0.287 . . . . 0.0 111.077 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.582 ' C ' ' H ' ' A' ' 98' ' ' ASP . 32.7 t -165.83 -75.88 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.581 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.9 tpt 66.67 -14.25 0.16 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.358 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.582 ' H ' ' C ' ' A' ' 96' ' ' SER . 95.1 m-20 -72.03 -19.45 61.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.219 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -68.89 -41.22 78.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.68 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 77.0 p . . . . . 0 CA--C 1.515 -0.4 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.731 -179.771 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.418 ' N ' HD12 ' A' ' 105' ' ' LEU . 10.9 mp . . . . . 0 CA--C 1.531 0.245 0 CA-C-O 120.539 0.209 . . . . 0.0 110.484 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 69.2 t -64.92 -45.79 93.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.947 0.403 . . . . 0.0 110.249 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -64.22 -32.19 73.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.999 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -61.6 -35.25 90.86 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.03 -38.29 88.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.539 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -56.97 -47.56 80.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.385 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 111' ' ' LEU . 5.1 tt -65.53 -46.24 80.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.586 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -50.86 -36.35 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.647 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.4 mt -61.49 -42.98 99.61 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.234 -0.586 . . . . 0.0 109.663 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -56.5 -42.54 78.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 110.151 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.86 -37.84 88.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.305 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 46.1 p . . . . . 0 N--CA 1.463 0.202 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.755 -179.993 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.7 t0 . . . . . 0 N--CA 1.449 -0.508 0 N-CA-C 110.706 -0.109 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.586 ' N ' HD22 ' A' ' 127' ' ' LEU . 3.6 mm? -71.49 -42.96 67.42 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.141 0.496 . . . . 0.0 111.16 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.85 -28.73 69.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.567 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 6.0 m -60.42 -49.85 75.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.154 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.14 -45.65 90.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.29 -41.99 96.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.644 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -55.33 -45.02 76.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.138 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -61.91 -47.05 86.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.726 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.4 tp -64.5 -49.12 72.58 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.456 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.599 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.08 -31.95 67.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.231 0.539 . . . . 0.0 110.214 -178.125 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.681 -179.293 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.73 0.3 . . . . 0.0 110.748 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -65.23 -44.6 87.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.009 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.13 -34.15 77.72 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.148 -179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -64.92 -43.32 93.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.069 0.462 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 150' ' ' VAL . 51.7 mtmt -66.46 -36.18 82.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.582 179.083 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 58.5 m -58.56 -43.77 89.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.262 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mmm -61.36 -46.56 89.72 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.356 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.0 -43.82 81.91 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.122 0.487 . . . . 0.0 110.673 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 146' ' ' LYS . 47.1 t -60.68 -45.28 97.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.563 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 36.3 mt -58.13 -45.66 86.95 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.434 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.85 -40.43 91.72 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.389 -0.525 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.23 -45.28 84.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.267 -178.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.54 -44.04 97.77 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.746 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.598 ' O ' HD23 ' A' ' 155' ' ' LEU . 4.0 tt -65.08 -51.66 60.14 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.031 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.68 -41.87 98.1 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.758 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -63.79 -36.73 84.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.311 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -62.32 -39.36 92.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.385 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.9 t -67.89 -49.47 68.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.668 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' ALA . . . . . 0.483 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -70.89 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.325 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 161' ' ' SER . . . . . 0.513 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 38.5 t -24.7 90.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.812 0.695 . . . . 0.0 111.186 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 162' ' ' HIS . . . . . 0.513 ' CG ' ' O ' ' A' ' 161' ' ' SER . 70.3 m-70 -160.74 38.25 0.16 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.423 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 p -101.26 150.41 37.13 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.631 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.63 166.08 30.54 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 122.807 2.338 . . . . 0.0 111.782 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 N--CA 1.463 0.208 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.645 179.83 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 62.0 mt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 121.015 0.436 . . . . 0.0 110.371 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -60.59 -45.45 93.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.099 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -65.48 -42.02 92.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.583 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 83.6 t -62.3 -44.64 99.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.325 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.17 -40.61 81.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -60.69 -44.48 96.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.418 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 11.9 m -64.89 -40.24 94.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.795 0.331 . . . . 0.0 110.618 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.7 m -58.35 -50.74 72.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.984 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.9 -33.36 61.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.584 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.062 179.625 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.563 ' N ' HD12 ' A' ' 182' ' ' LEU . 9.8 mp . . . . . 0 C--O 1.223 -0.306 0 CA-C-O 120.796 0.332 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -51.79 -43.72 63.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.471 -177.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.1 m -61.86 -52.25 64.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.81 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -66.65 -41.65 87.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.004 0.431 . . . . 0.0 110.965 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 182' ' ' LEU . 74.6 t -64.19 -43.44 97.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.554 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -57.68 -52.52 65.11 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.449 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 57.1 m -58.48 -49.04 78.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.701 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 49.2 tp . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.425 179.542 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.895 0.378 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -63.58 -37.2 86.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.372 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -60.31 -36.77 78.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.33 -49.71 75.9 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.875 0.369 . . . . 0.0 110.661 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 94.3 mt -64.54 -43.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.284 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.03 -43.27 97.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.787 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttm-85 -53.43 -53.69 47.63 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -58.0 -44.0 86.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.031 0.443 . . . . 0.0 110.632 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 93.1 mt -61.43 -50.47 80.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.563 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.09 -39.92 83.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.515 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 62.1 ttt85 -54.4 -45.71 72.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.034 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -63.31 -44.62 94.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.484 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.2 mt -64.66 -39.25 93.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.558 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.85 -44.56 74.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.117 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -64.51 -51.77 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.31 179.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -26.29 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.665 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.11 -19.79 56.64 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -62.74 -46.88 86.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.775 0.321 . . . . 0.0 110.536 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.0 m -77.41 -69.87 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.865 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.4 ttp -76.93 -177.66 4.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.13 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 55.75 36.37 27.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.764 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -105.81 2.04 27.44 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.643 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 120.933 0.397 . . . . 0.0 110.883 -179.817 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 N--CA 1.462 0.148 0 CA-C-O 120.815 0.34 . . . . 0.0 110.579 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.515 HG23 ' N ' ' A' ' 107' ' ' ASN . 35.7 m -64.17 -43.75 97.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.271 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.515 ' N ' HG23 ' A' ' 106' ' ' VAL . 27.2 t-20 -64.62 -50.56 66.68 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.966 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -63.08 -31.44 80.72 Favored Glycine 0 CA--C 1.522 0.507 0 N-CA-C 110.739 -0.945 . . . . 0.0 110.739 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.6 -48.45 81.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -47.74 84.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.443 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.55 ' O ' HD13 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -64.22 -45.75 86.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.123 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLN . . . . . 0.44 ' O ' ' OD1' ' A' ' 115' ' ' ASN . 58.1 tt0 -61.73 -35.31 77.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.031 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.2 tp -64.23 -33.42 75.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.392 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ARG . . . . . 0.453 ' C ' ' N ' ' A' ' 116' ' ' THR . 61.3 ttp180 -60.0 -40.76 90.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.741 -179.333 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 116' ' ' THR . 33.1 p-10 -48.82 -13.96 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.668 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.454 ' N ' ' OD1' ' A' ' 115' ' ' ASN . 99.5 m . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.692 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 39.2 t70 . . . . . 0 CA--C 1.522 -0.116 0 CA-C-O 120.617 0.246 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 pp -59.75 -31.66 69.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.702 0.286 . . . . 0.0 110.837 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.14 -40.35 70.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.18 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 27.0 m -60.79 -50.7 72.41 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.102 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.5 73.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.245 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.64 -46.23 89.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.137 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.28 -47.93 59.01 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.625 -0.43 . . . . 0.0 109.991 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -59.82 -43.55 94.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.671 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 5.7 tt -64.14 -41.27 97.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.978 0.418 . . . . 0.0 110.703 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -27.69 46.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 . . . . . 0 C--N 1.323 -0.578 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.023 -179.433 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 39.0 ttm . . . . . 0 N--CA 1.473 0.707 0 CA-C-O 120.98 0.419 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -66.06 -48.09 72.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.282 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -63.69 -36.46 83.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.143 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -71.32 -45.95 61.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.882 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -57.78 -49.45 76.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.419 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 3.5 m -64.41 -50.24 68.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.007 0.432 . . . . 0.0 110.514 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 21.8 ttp -62.13 -34.88 77.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.65 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 46.1 tp -59.67 -48.25 82.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.188 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.52 -43.96 95.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.568 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 56.7 tp -61.38 -45.88 92.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.379 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.92 73.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.405 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.4 tp -66.47 -39.39 88.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.43 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 37.6 mt -61.51 -45.83 92.55 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.466 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.421 HD22 ' N ' ' A' ' 155' ' ' LEU . 4.1 mm? -65.95 -39.81 90.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.681 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.22 -42.19 66.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.526 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -66.72 -41.78 87.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.689 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -61.49 -45.32 94.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.575 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 69.5 t -63.42 -44.89 99.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.38 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.48 -39.23 92.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.832 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 47.0 m -164.89 164.37 20.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -122.04 134.61 54.79 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' THR . . . . . 0.475 ' OG1' ' NH2' ' A' ' 168' ' ' ARG . 0.5 OUTLIER -90.24 157.3 45.34 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 120.641 0.257 . . . . 0.0 110.541 -179.371 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 163' ' ' THR . 76.3 Cg_exo -42.19 170.05 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.411 2.074 . . . . 0.0 111.959 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 79.9 p . . . . . 0 N--CA 1.466 0.331 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.623 179.796 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.503 ' N ' HD12 ' A' ' 167' ' ' LEU . 10.8 mp . . . . . 0 N--CA 1.463 0.182 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.475 ' NH2' ' OG1' ' A' ' 163' ' ' THR . 9.7 ptp180 -71.17 -34.44 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.608 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 169' ' ' ASP . . . . . 0.493 ' O ' HG23 ' A' ' 173' ' ' THR . 91.3 m-20 -62.31 -46.89 86.72 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.96 -179.13 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.449 ' O ' ' OG1' ' A' ' 173' ' ' THR . 7.5 p -69.97 -33.28 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.133 0.492 . . . . 0.0 110.119 179.152 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -59.16 -46.28 88.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.115 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -65.32 -42.24 93.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 173' ' ' THR . . . . . 0.493 HG23 ' O ' ' A' ' 169' ' ' ASP . 51.9 p -58.21 -46.09 86.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.348 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.8 m -59.63 -44.63 93.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.917 0.389 . . . . 0.0 110.341 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.79 -44.28 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.481 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.334 -179.15 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -59.11 -37.58 77.52 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.209 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -60.55 -46.99 88.15 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.392 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -64.0 -35.59 81.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 182' ' ' LEU . 62.0 t -59.82 -45.62 94.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.213 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.45 -49.9 73.58 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.691 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.5 t -59.96 -41.68 92.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.442 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.51 ' N ' HD22 ' A' ' 189' ' ' LEU . 3.8 mm? . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.687 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.2 m . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.877 0.37 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLN . . . . . 0.414 HE22 HD11 ' A' ' 83' ' ' ILE . 1.9 tm0? 72.08 -64.61 0.38 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.311 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -65.3 -47.0 78.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.574 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -65.88 -33.96 77.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.353 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.68 -43.37 98.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.857 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.414 HD11 HE22 ' A' ' 79' ' ' GLN . 94.2 mt -63.44 -43.84 98.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.201 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.62 -55.49 23.2 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -53.2 -46.25 68.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.3 mm -62.15 -45.58 98.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 179.046 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -50.88 -35.08 31.02 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.826 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.8 mmt-85 -66.15 -50.01 65.44 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.815 0.34 . . . . 0.0 110.091 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -69.44 -50.42 45.8 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.109 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.573 ' O ' HD23 ' A' ' 90' ' ' LEU . 1.3 tt -53.88 -41.68 67.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.004 0.431 . . . . 0.0 109.853 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.95 -48.51 81.51 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.922 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -64.47 -51.94 60.51 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.412 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.418 HG12 ' HA ' ' A' ' 90' ' ' LEU . 3.1 p -68.62 -31.84 52.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 109.894 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -60.23 -34.25 83.64 Favored Glycine 0 CA--C 1.519 0.292 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.41 -47.56 84.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.129 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.3 m -114.01 111.78 22.21 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.132 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 79.7 mtp -85.38 -102.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 43.9 t0 50.99 18.99 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.601 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -140.58 -53.46 0.5 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.2 p . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.25 -179.945 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.708 ' N ' HD12 ' A' ' 105' ' ' LEU . 6.4 mp . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.751 0.31 . . . . 0.0 110.735 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 107' ' ' ASN . 33.7 m -59.3 -50.4 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.913 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.605 ' N ' HG23 ' A' ' 106' ' ' VAL . 20.6 t-20 -57.36 -46.65 83.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.228 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.5 -42.57 95.67 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.083 -1.207 . . . . 0.0 110.083 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 tp -59.42 -40.84 88.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.78 -37.44 87.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.6 tp -61.74 -48.75 79.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.866 0.365 . . . . 0.0 111.27 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLN . . . . . 0.555 ' O ' ' N ' ' A' ' 116' ' ' THR . 3.9 pt20 -71.92 -45.17 62.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.033 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.99 -25.79 65.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.3 -179.271 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -79.33 -49.2 12.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.54 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -89.35 -56.71 3.15 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.053 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.555 ' N ' ' O ' ' A' ' 112' ' ' GLN . 1.7 m . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.031 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 42.4 t0 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 120.674 0.273 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.31 -41.26 70.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.124 0.488 . . . . 0.0 111.175 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.77 -28.58 70.08 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.791 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 96.6 m -59.67 -52.68 64.47 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.099 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.16 -47.34 74.33 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.817 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 30.5 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.379 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -53.6 -39.04 64.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.919 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -64.17 -36.55 84.41 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.562 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -61.64 -48.94 78.6 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.545 -178.757 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.472 HD22 ' N ' ' A' ' 135' ' ' LEU . 4.2 mm? -61.3 -29.76 70.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.435 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.279 179.916 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 2.5 ttt . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.874 0.369 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -65.36 -35.43 80.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.599 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -63.37 -40.99 98.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.776 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' GLU . . . . . 0.475 ' OE1' ' N ' ' A' ' 145' ' ' GLU . 57.9 mp0 -67.7 -52.45 37.59 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.794 -0.762 . . . . 0.0 109.51 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -53.15 -38.76 63.02 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.555 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 16.8 m -61.85 -43.31 99.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.511 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 50.6 mtt -62.66 -39.42 93.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.747 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.437 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.6 t -61.69 -42.3 93.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.281 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.41 -44.99 92.76 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.203 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.08 -31.5 72.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.818 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.74 -39.96 69.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.43 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 16.3 mt -60.87 -42.14 97.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.039 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.505 ' O ' HD13 ' A' ' 155' ' ' LEU . 0.2 OUTLIER -62.35 -49.79 74.15 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.667 -179.657 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.8 -36.04 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.621 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -62.27 -45.66 92.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.583 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.13 -41.39 98.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.768 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.7 t -61.51 -46.65 96.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.485 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.41 -48.81 76.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.971 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 37.2 t -162.94 158.98 23.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.456 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -134.21 133.14 40.55 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.933 0.397 . . . . 0.0 110.429 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.12 155.0 80.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.322 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.51 -19.4 54.8 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.627 2.218 . . . . 0.0 111.867 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' SER . . . . . 0.525 ' O ' ' N ' ' A' ' 167' ' ' LEU . 7.7 t . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.256 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 165' ' ' SER . 47.5 mt . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.889 0.376 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -62.55 -43.51 98.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 169' ' ' ASP . . . . . 0.442 ' O ' HG23 ' A' ' 173' ' ' THR . 98.8 m-20 -63.25 -44.14 96.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.651 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.444 ' O ' ' OG1' ' A' ' 173' ' ' THR . 71.0 t -63.41 -47.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.881 0.372 . . . . 0.0 110.398 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.07 -47.0 86.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.439 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -64.26 -40.34 95.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 173' ' ' THR . . . . . 0.444 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 8.9 p -62.94 -43.76 97.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.607 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.7 m -61.97 -50.46 72.02 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.473 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.6 t -62.08 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.213 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 -179.728 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.407 ' O ' HG22 ' A' ' 186' ' ' VAL . 53.7 tp . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.505 0.193 . . . . 0.0 110.505 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -51.45 -34.96 37.57 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.572 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -66.03 -50.59 63.69 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -61.83 -47.97 82.69 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.022 0.439 . . . . 0.0 111.686 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.407 HG22 ' O ' ' A' ' 182' ' ' LEU . 23.0 m -66.59 -32.97 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.253 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -59.67 -48.99 79.48 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.506 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.6 t -61.41 -42.75 99.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.76 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.365 -179.894 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.465 0.308 0 CA-C-O 121.067 0.461 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -65.33 -34.16 77.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.67 -33.74 76.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -61.91 -35.6 78.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.068 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.406 ' O ' HG22 ' A' ' 86' ' ' ILE . 95.6 mt -62.48 -45.42 98.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.216 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.533 ' O ' ' HB2' ' A' ' 87' ' ' ALA . 97.2 mt -65.99 -41.55 89.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.241 0.543 . . . . 0.0 110.388 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -69.12 -44.62 72.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.435 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -61.12 -56.18 23.88 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.035 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.473 HG23 ' N ' ' A' ' 87' ' ' ALA . 18.8 tt -61.47 -41.19 89.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.441 0.639 . . . . 0.0 109.756 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 83' ' ' ILE . . . -51.02 -40.21 57.67 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -68.58 -44.38 74.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.34 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -62.83 -50.34 71.34 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.8 mt -52.13 -39.82 60.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.126 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.96 -49.04 79.07 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.857 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.74 -50.77 55.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.284 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.473 HG22 HH21 ' A' ' 99' ' ' ARG . 87.3 t -60.23 -42.32 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.193 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -53.96 -43.42 71.8 Favored Glycine 0 CA--C 1.519 0.335 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -76.2 -47.16 25.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.542 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 98' ' ' ASP . 18.3 m -61.16 -71.8 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.532 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 73.7 mmm 66.07 -41.65 0.36 Allowed 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.693 0.621 . . . . 0.0 110.656 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.52 ' H ' ' C ' ' A' ' 96' ' ' SER . 68.2 t0 -61.88 -40.07 94.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.489 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.473 HH21 HG22 ' A' ' 93' ' ' VAL . 71.8 ttp85 -64.66 -43.36 93.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.401 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 51.5 m . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.381 -179.855 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.56 HD22 ' N ' ' A' ' 105' ' ' LEU . 3.7 mm? . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 13.8 p -70.77 -35.06 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.563 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -61.12 -40.84 95.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.509 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.13 -51.18 58.56 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 60.4 tp -62.86 -42.6 99.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.543 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.4 -48.48 81.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 tp -64.82 -45.06 87.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.742 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -67.77 -26.9 66.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.667 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.432 ' O ' ' OG1' ' A' ' 116' ' ' THR . 57.1 tp -61.51 -43.0 99.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.135 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -59.79 -34.11 72.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.836 0.351 . . . . 0.0 110.369 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -58.74 -40.37 83.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.224 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 113' ' ' LEU . 45.5 p . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.489 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.1 t0 . . . . . 0 N--CA 1.455 -0.194 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 31.8 mt -52.8 -38.24 60.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.535 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.12 -47.84 71.4 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 81.8 m -62.36 -43.75 98.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.861 0.362 . . . . 0.0 110.455 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.96 -47.5 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.537 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -61.57 -42.43 98.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.404 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -64.03 -52.71 58.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.058 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -61.33 -44.62 96.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.683 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.31 -51.12 65.05 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.4 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' A' ' 135' ' ' LEU . 41.4 tp -57.72 -38.89 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.302 -178.318 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.591 179.409 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 50.1 mtt . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.871 0.367 . . . . 0.0 110.642 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -67.25 -32.66 73.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.598 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -58.38 -43.34 88.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.667 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -66.49 -51.87 52.11 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.545 ' O ' HG23 ' A' ' 150' ' ' VAL . 97.7 mttt -52.69 -40.9 63.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.313 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.5 m -59.83 -51.49 69.5 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.758 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 78.0 mtm -68.66 -40.0 80.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.017 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 62.9 mt -63.61 -43.18 97.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.691 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 146' ' ' LYS . 40.9 t -60.78 -44.73 98.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.217 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 54.4 tp -61.02 -46.74 89.51 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.51 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.43 -35.91 81.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.5 tp -70.28 -35.68 73.9 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.929 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.566 ' O ' HD13 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -61.18 -45.96 92.47 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.868 -178.871 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.32 -46.06 91.84 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.313 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.2 -45.18 74.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.535 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -64.25 -36.54 84.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.339 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.29 -47.17 86.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.276 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 96.0 t -64.93 -45.26 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.708 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -57.36 -48.55 78.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.26 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' SER . . . . . 0.506 ' C ' ' CG ' ' A' ' 162' ' ' HIS . 97.9 p -110.13 -133.11 0.33 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.559 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 162' ' ' HIS . . . . . 0.506 ' CG ' ' C ' ' A' ' 161' ' ' SER . 0.1 OUTLIER -179.99 165.78 1.23 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.974 0.416 . . . . 0.0 109.953 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 4.6 p -73.02 149.76 89.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.65 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.68 -88.27 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.528 2.152 . . . . 0.0 112.307 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 165' ' ' SER . . . . . 0.49 ' O ' ' NE ' ' A' ' 168' ' ' ARG . 15.7 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.607 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 50.4 mt . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.699 0.285 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.497 ' CG ' ' N ' ' A' ' 169' ' ' ASP . 14.8 ptp180 -60.95 -45.61 94.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.519 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 169' ' ' ASP . . . . . 0.497 ' N ' ' CG ' ' A' ' 168' ' ' ARG . 67.1 t0 -65.26 -40.76 94.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.68 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.9 t -61.37 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.305 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -57.09 -47.29 81.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.46 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -61.55 -37.02 82.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.22 0.533 . . . . 0.0 110.142 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 79.4 m -65.78 -43.23 89.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.764 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 96.3 m -58.44 -52.36 65.95 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.939 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.4 p -60.66 -38.17 77.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.06 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 6.9 m120 . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.814 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.575 HD13 ' O ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.153 0 CA-C-O 121.077 0.465 . . . . 0.0 110.502 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -57.18 -46.71 82.58 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.21 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 15.3 m -57.23 -43.3 82.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.328 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -66.05 -34.18 77.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.007 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 182' ' ' LEU . 43.7 t -59.91 -48.55 87.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.559 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -62.28 -52.73 62.55 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.147 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 96.5 p -57.99 -22.05 47.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.767 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.566 ' O ' HD13 ' A' ' 189' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.352 -179.44 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.0 m . . . . . 0 CA--C 1.522 -0.1 0 CA-C-O 121.002 0.43 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -52.3 -29.63 24.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.588 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.26 -38.98 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.44 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.06 -43.54 98.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 87.9 mt -63.02 -43.16 98.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.615 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.1 mt -61.34 -42.4 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -54.01 -54.69 35.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -54.79 -40.17 69.19 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.687 0.279 . . . . 0.0 110.427 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.41 HD13 ' HA ' ' A' ' 86' ' ' ILE . 29.0 mm -64.49 -46.36 92.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.323 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.7 90.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.649 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -59.4 -48.96 79.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.823 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -66.79 -40.54 88.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.089 0.471 . . . . 0.0 110.118 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.542 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.2 tt -67.24 -37.43 83.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.511 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.59 -47.8 83.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.75 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -64.74 -52.17 58.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.554 -0.459 . . . . 0.0 110.153 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.88 -26.74 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.578 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -76.14 -31.28 55.61 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -61.76 -46.98 87.24 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p -66.48 -32.05 73.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.554 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 60.8 ttp -61.35 -36.18 79.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.388 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.54 -17.22 59.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.939 0.4 . . . . 0.0 110.314 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -59.38 -44.92 92.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.072 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.465 0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.139 179.547 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.684 ' N ' HD23 ' A' ' 105' ' ' LEU . 1.8 pt? . . . . . 0 CA--C 1.527 0.079 0 CA-C-O 120.905 0.383 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 66.2 t -58.93 -46.13 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.403 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -59.87 -45.05 93.72 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.087 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -77.15 -22.66 70.54 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.457 ' N ' ' O ' ' A' ' 105' ' ' LEU . 53.4 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.325 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.04 -48.07 77.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.322 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.76 -43.36 93.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.428 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -44.86 75.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.258 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 tp -63.51 -44.64 93.7 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.388 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -51.37 -38.28 52.5 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.86 -51.55 54.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.046 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 21.0 m . . . . . 0 C--O 1.233 0.186 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.311 -179.915 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 48.9 t0 . . . . . 0 CA--C 1.519 -0.226 0 N-CA-C 110.427 -0.212 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.0 -33.5 75.87 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.55 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -44.15 71.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.087 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.8 m -60.33 -51.41 69.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.19 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.27 -46.39 80.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.159 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 36.7 tp -61.58 -43.35 99.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.567 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -62.41 -51.56 67.05 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.387 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mm-40 -60.87 -39.86 90.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.141 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.2 tp -61.55 -51.39 68.76 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.781 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.574 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -59.64 -38.13 80.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.299 0.571 . . . . 0.0 110.44 -177.808 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 . . . . . 0 C--N 1.315 -0.913 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.312 179.9 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 10.7 ptm . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.644 0.259 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -64.41 -37.89 89.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 0.0 110.141 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -64.15 -46.01 85.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.033 0.444 . . . . 0.0 110.066 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -55.28 -30.16 59.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.64 -178.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 150' ' ' VAL . 97.4 mttt -69.13 -43.73 73.78 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.214 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.429 ' O ' ' CB ' ' A' ' 151' ' ' LEU . 84.2 m -69.96 -36.02 74.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.537 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.4 mtt -60.27 -46.03 91.23 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.02 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.3 mp -73.25 -50.6 21.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.43 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 146' ' ' LYS . 79.1 t -60.56 -45.74 96.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.498 -178.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.429 ' CB ' ' O ' ' A' ' 147' ' ' THR . 56.6 tp -58.05 -44.72 87.58 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.496 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.87 -36.7 82.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.516 ' CG ' ' HZ3' ' A' ' 157' ' ' LYS . 38.5 tp -63.67 -42.05 98.11 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.912 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.34 -42.42 95.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.414 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.22 -40.24 96.9 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.75 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.16 -39.02 69.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.269 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 157' ' ' LYS . . . . . 0.516 ' HZ3' ' CG ' ' A' ' 153' ' ' LEU . 31.2 mttp -62.73 -44.68 95.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.834 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.7 -44.21 97.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.457 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 80.7 t -65.48 -43.06 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.085 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -60.15 -47.63 85.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.81 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 74.5 m -167.89 168.12 12.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.39 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -117.92 127.04 53.47 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.989 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.46 156.91 59.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.643 -179.27 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -69.67 157.59 60.04 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.954 2.436 . . . . 0.0 112.537 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.056 179.692 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 167' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.458 -0.075 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -59.08 -43.32 91.77 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.221 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.98 -43.28 99.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.677 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.452 ' O ' ' OG1' ' A' ' 173' ' ' THR . 96.4 t -62.88 -43.34 98.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.066 0.46 . . . . 0.0 110.221 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -56.29 -49.24 74.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -61.86 -45.35 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.544 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 173' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 19.4 p -58.37 -45.69 87.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.195 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -54.04 -45.71 71.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 110.272 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 86.0 t -61.13 -44.42 98.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.782 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.499 -179.978 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.474 0.178 . . . . 0.0 110.824 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -60.11 -45.59 92.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.245 0.545 . . . . 0.0 110.021 -179.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -57.18 -44.62 83.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.809 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -58.17 -39.7 79.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.58 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.5 t -58.43 -50.2 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.035 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -68.47 -45.84 71.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.299 0.571 . . . . 0.0 110.745 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 23.6 p -58.64 -35.07 71.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.998 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 85.3 mt . . . . . 0 N--CA 1.464 0.235 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.266 179.789 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 N--CA 1.467 0.42 0 CA-C-O 120.916 0.389 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -60.66 -31.52 70.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.952 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -66.89 -36.61 82.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.449 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -61.52 -45.27 94.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.158 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.453 ' O ' HG22 ' A' ' 86' ' ' ILE . 96.6 mt -65.08 -44.38 95.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.354 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.405 ' O ' ' HB2' ' A' ' 87' ' ' ALA . 97.2 mt -66.07 -41.11 88.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.253 0.549 . . . . 0.0 110.27 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -70.61 -50.31 38.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.851 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -52.91 -55.09 25.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.303 -178.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.535 HG23 ' N ' ' A' ' 87' ' ' ALA . 21.0 tt -63.29 -44.61 99.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.724 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.535 ' N ' HG23 ' A' ' 86' ' ' ILE . . . -51.13 -39.38 56.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.955 -178.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -65.26 -49.79 68.26 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.411 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -66.94 -52.15 46.47 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 120.337 -0.545 . . . . 0.0 109.896 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.421 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.6 tt -52.84 -38.48 61.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.114 -179.049 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.67 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.748 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -67.76 -46.01 73.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.854 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 96' ' ' SER . 69.3 t -66.23 -40.38 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.195 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -55.78 -42.91 86.7 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -61.69 -47.48 85.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.199 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 93' ' ' VAL . 46.7 t -109.07 110.8 22.15 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.075 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.435 ' O ' ' O ' ' A' ' 98' ' ' ASP . 10.8 ttm -64.95 -11.34 37.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.924 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.488 ' O ' ' N ' ' A' ' 100' ' ' SER . 98.8 m-20 -53.29 -167.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 51.5 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.154 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 98' ' ' ASP . 48.1 t . . . . . 0 C--N 1.329 -0.312 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 77.7 mt . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.735 0.302 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -34.56 62.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.066 0.46 . . . . 0.0 110.467 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.33 -41.6 98.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.174 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.83 -42.24 59.42 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.599 ' O ' HD23 ' A' ' 109' ' ' LEU . 3.1 tt -60.75 -48.45 81.73 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.994 0.426 . . . . 0.0 110.041 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.78 93.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.526 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.611 HD23 ' O ' ' A' ' 111' ' ' LEU . 2.9 tt -63.31 -47.56 81.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.943 0.401 . . . . 0.0 110.165 -179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.86 -39.71 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.307 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.23 -42.31 99.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.402 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -64.8 -38.08 89.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.17 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.13 -37.97 75.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.155 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.497 179.925 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 64.2 t0 . . . . . 0 N--CA 1.462 0.125 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 60.2 mt -52.01 -33.13 37.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.672 0.272 . . . . 0.0 110.577 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.41 -49.62 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.817 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 15.5 m -62.95 -42.72 99.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.334 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.46 -46.92 80.13 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.0 mt -58.93 -41.26 86.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -54.94 -52.43 63.02 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.707 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -51.98 -47.91 64.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.107 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.556 HD13 ' O ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -64.1 -42.89 96.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.512 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -56.63 -47.69 79.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.036 -178.806 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.214 -179.926 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.274 0 CA-C-O 121.01 0.433 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -66.84 -40.96 88.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.479 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -60.84 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.199 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -72.59 -52.52 15.15 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.992 -0.683 . . . . 0.0 109.289 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -52.36 -39.7 61.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.236 -179.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 70.6 m -63.64 -44.17 94.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.617 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 18.9 mtm -62.89 -38.75 92.14 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.577 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.12 -41.79 99.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.076 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 75.8 t -63.39 -42.54 96.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.623 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.82 -45.26 90.38 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.195 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.41 -31.56 72.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.306 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 10.1 tp -71.98 -41.32 67.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.896 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.994 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.46 -44.09 95.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.17 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.8 -40.67 79.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.016 0.436 . . . . 0.0 110.312 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -64.2 -42.72 96.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.045 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.29 -45.12 94.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.308 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 70.5 t -62.29 -45.81 97.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.16 -41.43 97.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.767 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 28.8 t -142.97 145.14 32.69 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.366 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 35.8 m80 -68.64 -139.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.479 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 5.3 p -140.05 150.57 62.51 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.081 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.445 ' O ' ' CB ' ' A' ' 165' ' ' SER . 44.2 Cg_exo -41.96 -64.58 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 122.232 1.955 . . . . 0.0 112.565 179.557 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 165' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.5 m . . . . . 0 CA--C 1.533 0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.311 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 58.0 mt . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.678 0.275 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -65.06 -42.48 94.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 0.0 110.626 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -64.87 -43.84 91.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.658 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.9 t -61.19 -45.65 98.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.097 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -57.29 -42.91 82.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.097 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -59.78 -40.57 88.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.605 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 20.1 m -59.84 -44.89 93.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -59.36 -45.93 90.04 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 110.639 -179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.09 -44.53 95.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.146 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 40.3 t30 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.541 -179.983 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.804 0.335 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -57.36 -36.88 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.5 m -59.69 -51.03 71.51 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.733 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -66.83 -39.86 87.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.113 0.482 . . . . 0.0 110.691 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.24 -39.65 83.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.332 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -61.23 -44.62 96.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.644 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 72.3 m -58.49 -38.31 77.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.361 . . . . 0.0 110.391 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 57.3 tp . . . . . 0 C--N 1.328 -0.336 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.204 179.829 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 56.2 p . . . . . 0 N--CA 1.461 0.085 0 CA-C-O 120.939 0.399 . . . . 0.0 110.683 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -47.37 -29.94 2.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.555 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -67.2 -33.87 76.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.689 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -55.72 -46.79 77.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.522 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.672 HD12 ' N ' ' A' ' 82' ' ' ILE . 2.0 mp -62.79 -46.04 97.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.357 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 97.2 mt -62.11 -43.04 97.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.684 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.3 ttt85 -50.97 -49.96 59.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.643 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -56.46 -43.85 79.95 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.632 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.89 -50.1 81.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.456 -0.497 . . . . 0.0 109.722 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.1 89.85 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -57.8 -48.5 79.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.67 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -66.75 -40.42 88.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.158 0.504 . . . . 0.0 110.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 94' ' ' GLY . 5.9 tt -66.91 -38.87 87.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.625 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.405 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -59.97 -42.02 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.628 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -65.41 -52.51 52.82 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.921 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.5 t -69.66 -26.08 29.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.815 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -85.5 -37.36 9.71 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.224 -0.75 . . . . 0.0 111.224 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.455 ' O ' ' O ' ' A' ' 96' ' ' SER . 42.7 t0 -72.05 -46.46 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.614 0.245 . . . . 0.0 110.941 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.457 ' C ' ' H ' ' A' ' 98' ' ' ASP . 70.9 m -57.62 -123.22 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.917 0.389 . . . . 0.0 111.034 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.6 ttt 62.66 1.44 0.79 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.035 0.445 . . . . 0.0 110.251 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.457 ' H ' ' C ' ' A' ' 96' ' ' SER . 43.5 t0 -62.74 -37.59 87.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.512 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -66.98 135.48 53.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.537 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 t . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.472 -179.995 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.568 HD12 ' N ' ' A' ' 105' ' ' LEU . 9.9 mp . . . . . 0 N--CA 1.464 0.25 0 CA-C-O 120.909 0.385 . . . . 0.0 110.296 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.36 -32.75 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.735 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.423 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 56.5 t-20 -60.32 -30.19 69.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.14 0.495 . . . . 0.0 110.518 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -64.42 -47.72 81.38 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.631 ' N ' HD22 ' A' ' 109' ' ' LEU . 3.5 mm? -62.91 -38.52 91.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.719 0.295 . . . . 0.0 110.708 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.99 73.31 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.236 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.608 HD23 ' O ' ' A' ' 111' ' ' LEU . 2.6 tt -70.63 -48.09 56.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -61.79 -25.49 67.51 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.689 -179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.41 ' N ' ' O ' ' A' ' 109' ' ' LEU . 58.6 tp -60.22 -43.11 96.27 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.17 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.59 -42.64 98.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.576 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -65.46 -43.37 90.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.686 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.9 m . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.66 179.794 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.1 t0 . . . . . 0 CA--C 1.522 -0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.3 pp -50.76 -32.22 19.13 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.983 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.76 -48.24 69.91 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.972 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 8.4 m -60.2 -38.6 83.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.085 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -47.55 78.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.15 -44.43 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.479 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.86 -51.03 68.6 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.891 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -54.82 -37.88 66.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.598 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.8 tp -60.04 -51.14 70.92 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.28 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.11 -44.22 97.68 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.3 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 . . . . . 0 C--N 1.325 -0.496 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.595 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.3 mtt . . . . . 0 N--CA 1.462 0.149 0 CA-C-O 120.798 0.332 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -59.99 -42.52 94.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.415 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.31 -33.54 73.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.654 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -70.2 -44.2 69.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.375 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.4 ' O ' HG23 ' A' ' 150' ' ' VAL . 53.7 mtmt -66.5 -39.46 88.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.736 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 72.5 m -59.7 -43.3 94.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.444 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 49.2 mtt -61.15 -45.97 92.45 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.152 -179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.33 -50.36 33.16 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.516 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 146' ' ' LYS . 71.0 t -58.73 -43.41 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.095 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.37 -45.92 90.11 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.48 82.39 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.916 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.61 -39.93 77.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.452 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.41 -41.72 90.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.61 -44.61 95.87 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.017 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.78 78.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.998 0.428 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 161' ' ' SER . 0.9 OUTLIER -60.27 -45.71 92.36 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.858 -179.244 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.55 -37.71 87.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.588 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 97.2 t -69.11 -51.72 40.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' ALA . . . . . 0.692 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -72.53 -50.54 25.01 Favored 'General case' 0 C--O 1.218 -0.578 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.184 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 161' ' ' SER . . . . . 0.502 ' N ' ' O ' ' A' ' 157' ' ' LYS . 78.2 p 24.18 35.02 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.171 0.51 . . . . 0.0 111.165 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 162' ' ' HIS . . . . . 0.692 ' N ' ' O ' ' A' ' 160' ' ' ALA . 5.7 p80 -155.98 137.99 14.52 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.389 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.1 m -162.62 128.22 2.22 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.22 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -44.16 -31.38 4.08 Favored 'Trans proline' 0 N--CA 1.49 1.306 0 C-N-CA 121.85 1.7 . . . . 0.0 112.409 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' SER . . . . . 0.507 ' O ' ' N ' ' A' ' 167' ' ' LEU . 1.1 m . . . . . 0 C--N 1.331 -0.198 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' A' ' 165' ' ' SER . 85.5 mt . . . . . 0 N--CA 1.456 -0.14 0 CA-C-O 121.101 0.477 . . . . 0.0 110.234 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.43 -42.04 79.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.046 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -60.7 -47.09 87.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.081 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.422 HG23 ' N ' ' A' ' 171' ' ' PHE . 27.8 m -70.71 -40.04 76.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.657 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 171' ' ' PHE . . . . . 0.45 ' O ' HG23 ' A' ' 175' ' ' VAL . 86.3 t80 -58.53 -45.41 88.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.52 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -47.13 79.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.665 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.88 -39.9 91.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.611 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 71.2 m -60.41 -44.6 95.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.876 0.369 . . . . 0.0 110.443 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 175' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 171' ' ' PHE . 73.0 t -63.72 -40.6 89.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.549 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 . . . . . 0 C--N 1.326 -0.43 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.269 -179.707 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' ' 182' ' ' LEU . 4.1 mm? . . . . . 0 C--O 1.223 -0.32 0 CA-C-O 120.589 0.233 . . . . 0.0 110.551 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 64.0 ttm-85 -51.89 -42.29 62.59 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.726 -179.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.4 m -61.44 -52.3 65.13 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.689 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.64 -40.81 76.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.83 0.348 . . . . 0.0 110.808 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.72 -43.77 96.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.316 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.0 ttp85 -59.72 -53.04 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.613 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 21.4 m -63.22 -40.43 97.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 49.9 tp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.561 -179.356 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.464 0.245 0 CA-C-O 120.757 0.313 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -66.06 -20.76 66.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.592 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.15 -38.7 80.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.459 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.65 -46.91 86.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.815 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.13 -43.75 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 -179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.74 -42.85 97.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -54.89 -47.32 74.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.658 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -62.02 -43.17 99.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.029 0.442 . . . . 0.0 110.516 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.7 mt -59.51 -44.25 92.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.72 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.74 -40.95 98.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.02 0.438 . . . . 0.0 110.243 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -54.65 -45.34 73.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.532 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -65.02 -41.45 95.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.603 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 94' ' ' GLY . 9.5 mt -66.43 -39.56 89.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.479 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.62 -46.46 77.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.184 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -61.68 -52.14 65.53 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.028 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.02 -25.84 36.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.7 -29.15 24.67 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.446 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.7 t70 -61.34 -45.84 92.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.785 0.326 . . . . 0.0 110.727 -179.808 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 90.0 p -136.45 104.91 5.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.934 0.397 . . . . 0.0 110.466 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 39.1 ttp -127.35 -16.86 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.373 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -64.9 -31.5 72.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.575 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -65.09 -40.4 94.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.186 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.943 -179.461 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.871 0.367 . . . . 0.0 110.31 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 12.2 p -59.53 -32.9 50.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.532 -179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.9 -44.72 96.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.89 -41.09 91.34 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.76 -44.31 96.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.145 0.498 . . . . 0.0 110.401 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.04 93.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.61 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.402 ' O ' ' N ' ' A' ' 115' ' ' ASN . 63.7 mt -63.28 -41.49 99.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.628 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLN . . . . . 0.471 ' O ' HG22 ' A' ' 116' ' ' THR . 85.4 mm-40 -58.18 -47.34 83.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.455 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 64.6 tp -68.73 -43.46 75.87 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 121.544 0.688 . . . . 0.0 110.31 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.56 -37.52 86.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.216 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 111' ' ' LEU . 40.0 t30 -63.9 -44.35 93.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.028 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 112' ' ' GLN . 10.0 t . . . . . 0 C--N 1.332 -0.192 0 CA-C-O 120.793 0.33 . . . . 0.0 110.416 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.1 t0 . . . . . 0 C--O 1.232 0.151 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 65.9 mt -54.49 -31.44 55.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.714 0.292 . . . . 0.0 110.671 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.16 -47.06 75.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.421 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 23.4 m -63.68 -44.21 94.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.9 -47.74 81.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.615 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.95 -41.16 95.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.415 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -61.7 -48.88 78.77 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.98 -44.61 95.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.658 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.78 -53.32 57.57 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.306 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.568 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -59.68 -38.92 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.463 -0.495 . . . . 0.0 109.857 -178.112 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 . . . . . 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.624 179.809 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 30.5 ttm . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.831 0.348 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 147' ' ' THR . 22.6 pt-20 -53.87 -35.32 61.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.197 0.522 . . . . 0.0 110.718 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' LYS . . . . . 0.488 ' O ' ' OG1' ' A' ' 147' ' ' THR . 47.1 tttp -64.16 -34.82 78.96 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.281 0.563 . . . . 0.0 111.147 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.78 -48.9 65.04 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.773 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.452 ' O ' HG23 ' A' ' 150' ' ' VAL . 46.4 pttt -70.31 -31.69 69.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.004 0.43 . . . . 0.0 110.367 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' THR . . . . . 0.811 HG23 ' O ' ' A' ' 143' ' ' GLU . 12.2 p -60.11 -45.92 91.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.032 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mtm -62.49 -46.06 90.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.059 179.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' LEU . . . . . 0.419 HD22 ' N ' ' A' ' 149' ' ' LEU . 4.2 mm? -65.35 -47.41 76.55 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 119.591 -0.844 . . . . 0.0 110.256 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 150' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 146' ' ' LYS . 45.7 t -60.89 -41.08 87.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.561 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.1 tp -57.79 -45.21 86.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.629 -179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.01 -41.26 95.52 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.613 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.69 -43.51 98.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.607 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.9 mt -60.78 -43.54 97.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.161 0.505 . . . . 0.0 110.031 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.541 ' O ' HD13 ' A' ' 155' ' ' LEU . 0.2 OUTLIER -62.56 -44.48 96.24 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.685 -179.552 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.73 -35.99 75.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.495 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.14 -48.85 79.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.453 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -64.0 -40.72 97.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.916 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 155' ' ' LEU . 76.9 t -66.32 -46.11 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.931 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -66.06 -36.06 82.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.962 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.6 p -159.17 162.92 36.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.548 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -88.87 -161.61 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 12.9 p -84.95 147.84 49.26 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.973 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -41.48 -71.79 0.05 OUTLIER 'Trans proline' 0 N--CA 1.49 1.31 0 C-N-CA 122.284 1.99 . . . . 0.0 112.456 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 4.9 t . . . . . 0 CA--C 1.532 0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.997 -179.4 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.552 ' N ' HD12 ' A' ' 167' ' ' LEU . 10.4 mp . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 121.066 0.46 . . . . 0.0 110.123 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -59.93 -41.99 92.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.698 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -68.25 -46.37 70.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.124 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.08 -45.94 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.473 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -60.05 -39.31 85.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.371 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.51 -49.25 78.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.348 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 23.8 m -61.07 -46.86 88.93 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.062 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.3 m -52.66 -42.42 64.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.125 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.4 -44.34 99.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.773 0.321 . . . . 0.0 110.688 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 179.469 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.48 ' O ' HG23 ' A' ' 186' ' ' VAL . 56.6 mt . . . . . 0 C--O 1.223 -0.29 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -51.32 -45.78 62.36 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.965 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.1 m -62.63 -51.29 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.121 0.486 . . . . 0.0 110.008 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -62.08 -40.33 95.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.203 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 182' ' ' LEU . 42.0 t -62.7 -44.2 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.616 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 67.2 mmt-85 -58.05 -53.62 56.23 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.148 -178.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 69.1 m -58.56 -40.92 84.42 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.497 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 84.8 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.386 -179.911 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.78 0.324 . . . . 0.0 110.428 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.49 -34.54 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.406 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -60.13 -39.51 86.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.325 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -62.12 -46.16 90.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.445 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.69 -43.73 93.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.604 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.2 mt -60.69 -41.73 89.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -58.36 -55.05 40.03 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.803 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -52.86 -52.25 57.99 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.668 -178.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.59 -51.21 73.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.043 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -57.36 -36.86 71.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.26 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -61.87 -45.91 91.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.526 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -66.02 -43.29 88.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.931 0.396 . . . . 0.0 110.14 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.558 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.8 mp -71.42 -33.69 69.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.048 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.486 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -56.9 -48.43 78.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.439 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -72.18 -52.54 16.07 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.906 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 88.3 t -66.68 -26.33 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 121.039 0.447 . . . . 0.0 110.745 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -75.97 -37.04 39.51 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.13 -47.6 79.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.495 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.3 p -106.16 106.67 17.29 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 110.383 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.462 ' O ' ' SD ' ' A' ' 97' ' ' MET . 2.3 tmm? -171.0 -32.6 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 98' ' ' ASP . 35.5 p-10 -65.67 -22.87 66.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.956 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -60.5 -38.57 84.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.7 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.621 179.771 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.0 mt . . . . . 0 C--O 1.232 0.142 0 CA-C-O 121.007 0.432 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.45 ' H ' HG22 ' A' ' 106' ' ' VAL . 3.2 m -66.44 -37.74 80.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.71 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -62.43 -41.31 98.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 0.0 110.194 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -67.89 -48.72 53.11 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.34 -41.47 98.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.142 0.496 . . . . 0.0 110.335 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.46 -48.44 74.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.337 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.73 -43.11 97.49 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.615 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -61.78 -34.93 76.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.728 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 113' ' ' LEU . 40.0 mt -62.73 -42.68 99.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.31 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -78.12 -20.75 51.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.169 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -62.73 -34.79 77.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.307 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.2 m . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.656 -179.408 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 47.2 t0 . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.305 0.098 . . . . 0.0 110.739 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.7 mt -65.4 -34.71 78.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.729 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.42 -44.68 72.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.6 m -63.73 -46.56 84.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.401 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.19 -43.45 95.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.771 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 81.2 mt -61.64 -43.6 98.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.79 0.329 . . . . 0.0 110.22 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -68.65 -46.42 69.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.288 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -62.02 -51.49 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.748 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.5 tp -63.7 -47.9 79.29 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.855 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.33 -28.54 66.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.898 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.169 -178.195 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 36.2 ttm . . . . . 0 N--CA 1.467 0.377 0 CA-C-O 120.791 0.329 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -66.32 -35.35 80.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.566 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 20.6 tptt -60.58 -34.06 73.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.146 0.498 . . . . 0.0 110.457 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -76.56 -35.92 57.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.529 178.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -68.54 -47.13 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.555 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 73.3 m -61.92 -42.63 99.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.116 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 48.5 tpp -54.76 -46.25 74.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.97 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 94.6 mt -70.06 -46.71 64.39 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.724 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 76.3 t -60.05 -44.75 95.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.542 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.2 tt -61.46 -44.82 96.42 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.042 0.449 . . . . 0.0 110.866 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.48 89.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 43.1 tp -58.46 -40.77 83.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.187 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.46 -43.87 96.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.251 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 96.7 mt -65.48 -46.57 79.24 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.318 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.24 -40.39 90.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.095 0.474 . . . . 0.0 110.194 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 157' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 161' ' ' SER . 19.3 tptm -64.49 -35.33 80.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.719 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.24 -40.31 95.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.322 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 57.8 t -75.85 -50.24 23.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.865 179.012 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' ALA . . . . . 0.65 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -67.69 -50.1 59.38 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.814 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 161' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 160' ' ' ALA . 66.8 m 25.12 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.739 0.649 . . . . 0.0 111.487 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 162' ' ' HIS . . . . . 0.65 ' N ' ' O ' ' A' ' 160' ' ' ALA . 90.0 m-70 -147.88 120.58 8.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.285 -177.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.37 175.57 2.65 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.319 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -57.23 -153.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.473 2.115 . . . . 0.0 111.753 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.416 179.571 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 47.5 mt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.747 0.308 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -59.74 -44.94 93.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.577 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -64.45 -44.12 92.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.95 0.405 . . . . 0.0 110.709 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 92.9 t -64.42 -44.16 97.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.786 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -59.92 -42.18 93.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.419 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.9 -49.3 78.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.493 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.8 m -59.41 -46.19 89.4 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.058 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.6 m -52.57 -44.99 66.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.825 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 75.0 t -58.93 -41.69 83.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.078 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 176' ' ' ASN . . . . . 0.403 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 55.5 t-20 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 63.1 tp . . . . . 0 N--CA 1.456 -0.128 0 CA-C-O 120.628 0.251 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -60.51 -38.33 84.01 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.531 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 72.5 m -59.14 -44.95 92.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.229 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -61.84 -39.63 92.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.452 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.4 t -60.67 -48.72 87.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.513 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -63.82 -32.79 74.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.27 0.557 . . . . 0.0 110.687 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 16.3 m -57.34 -33.21 67.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.287 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.452 ' N ' HD22 ' A' ' 189' ' ' LEU . 4.1 mm? . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.525 179.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 p . . . . . 0 N--CA 1.468 0.428 0 CA-C-O 120.761 0.315 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -61.97 -43.24 99.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.489 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -67.33 -33.77 75.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.506 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -60.5 -37.38 80.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.603 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 93.6 mt -62.7 -44.36 99.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.38 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.6 mt -63.79 -44.7 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -55.59 -43.89 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.857 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.458 ' OD1' ' CD2' ' A' ' 89' ' ' HIS . 45.9 t-20 -63.97 -42.52 97.21 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.003 0.43 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.7 mt -60.3 -44.49 95.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.111 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.6 -50.34 73.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.963 0.411 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 94.1 mtm-85 -54.07 -45.95 71.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.458 ' CD2' ' OD1' ' A' ' 85' ' ' ASN . 36.1 m-70 -66.93 -41.82 86.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.075 0.464 . . . . 0.0 110.221 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.693 ' O ' HD23 ' A' ' 90' ' ' LEU . 3.2 tt -64.58 -41.7 96.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.099 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.17 82.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.396 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -65.24 -52.21 55.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.423 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.8 t -71.39 -26.4 26.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.045 0.45 . . . . 0.0 110.657 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -79.91 -40.73 13.73 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.45 -47.08 77.41 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.663 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.0 p -75.0 -31.24 61.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 54.92 -170.54 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.257 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.641 ' C ' ' H ' ' A' ' 100' ' ' SER . 51.7 t0 -86.35 2.25 48.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 60.66 -10.4 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.654 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.641 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.9 m . . . . . 0 N--CA 1.451 -0.416 0 CA-C-O 120.952 0.406 . . . . 0.0 110.08 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.534 HD12 ' N ' ' A' ' 105' ' ' LEU . 10.3 mp . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.874 0.368 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 107' ' ' ASN . 12.6 p -50.48 -36.32 13.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.399 -178.678 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.432 ' N ' HG13 ' A' ' 106' ' ' VAL . 98.5 m-20 -61.25 -40.07 92.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.871 0.367 . . . . 0.0 110.159 179.774 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.05 -39.89 81.08 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 109' ' ' LEU . 9.6 mp -63.58 -42.78 98.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.519 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -39.02 86.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.9 -39.8 95.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.358 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -57.98 -47.74 82.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.761 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.79 -21.83 63.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.618 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -87.73 -55.49 3.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.587 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 32.8 m . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.722 -179.584 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 63.8 t0 . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 120.595 0.236 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.6 mt -51.48 -35.76 41.37 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.98 70.15 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.225 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 99.7 m -63.29 -42.12 99.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.105 179.446 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.01 80.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.15 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.96 -42.37 93.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.825 0.345 . . . . 0.0 110.339 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -63.94 -49.96 70.54 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.232 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.82 -36.45 83.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.498 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.62 -55.04 39.4 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.445 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.27 -31.65 70.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.977 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 . . . . . 0 C--N 1.318 -0.78 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.112 -179.887 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 47.9 ttp . . . . . 0 N--CA 1.464 0.238 0 CA-C-O 120.755 0.312 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -65.26 -44.6 87.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -61.57 -49.58 76.08 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.784 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.44 -35.24 65.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.757 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -69.17 -49.85 52.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.209 0.528 . . . . 0.0 110.884 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 54.4 m -71.0 -41.21 71.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.762 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 53.1 ttm -52.88 -46.17 67.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 75.8 mt -63.91 -49.77 71.36 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.292 179.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.24 -45.06 99.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.56 HD13 ' O ' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -61.99 -46.68 88.17 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.184 0.516 . . . . 0.0 110.321 -179.293 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -59.03 -41.27 87.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.146 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 49.1 tp -59.75 -41.66 91.47 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.334 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.58 -42.86 97.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.004 0.43 . . . . 0.0 110.223 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.73 -46.53 87.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.205 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.17 -37.21 78.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 157' ' ' LYS . . . . . 0.699 ' HZ1' HH12 ' A' ' 168' ' ' ARG . 88.6 tttt -62.29 -45.03 95.08 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.563 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -63.03 -38.09 89.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.5 t -66.33 -44.79 90.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.569 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.78 81.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.362 -179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 37.7 m -171.1 173.49 5.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 162' ' ' HIS . . . . . 0.584 ' ND1' ' N ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER 179.25 69.08 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 84.7 m -116.87 81.7 12.37 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.42 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 164' ' ' PRO . . . . . 0.436 ' O ' ' CB ' ' A' ' 165' ' ' SER . 73.0 Cg_endo -82.04 -179.44 4.76 Favored 'Trans proline' 0 C--N 1.312 -1.361 0 C-N-CA 122.681 2.254 . . . . 0.0 111.872 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 165' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 179.395 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.696 HD23 ' N ' ' A' ' 167' ' ' LEU . 2.0 pt? . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 121.217 0.532 . . . . 0.0 110.317 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.699 HH12 ' HZ1' ' A' ' 157' ' ' LYS . 55.5 mtp85 -72.18 -40.85 67.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.893 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.03 -47.05 84.7 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.989 0.423 . . . . 0.0 111.275 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.435 HG13 ' N ' ' A' ' 171' ' ' PHE . 5.8 p -65.41 -41.36 90.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.235 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 171' ' ' PHE . . . . . 0.435 ' N ' HG13 ' A' ' 170' ' ' VAL . 76.7 t80 -61.59 -40.9 96.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.356 179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -58.21 -47.97 81.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.353 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.7 m -58.46 -42.5 87.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.896 0.379 . . . . 0.0 110.434 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 72.3 m -57.32 -42.71 82.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.081 0.467 . . . . 0.0 110.305 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.06 -40.95 84.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.359 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 120.955 0.407 . . . . 0.0 110.384 -179.882 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.572 HD13 ' O ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.225 0 CA-C-O 121.299 0.571 . . . . 0.0 110.2 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.75 -47.28 80.42 Favored 'General case' 0 C--N 1.321 -0.63 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.137 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.4 m -59.2 -43.72 92.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.089 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.2 -38.97 84.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.56 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -59.75 -49.6 83.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.082 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 91.3 mtt-85 -68.46 -52.33 33.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 74.6 m -57.84 -37.04 73.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.115 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.531 ' C ' HD23 ' A' ' 189' ' ' LEU . 3.2 tt . . . . . 0 C--N 1.332 -0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.085 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.609 0.242 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -45.36 -36.39 4.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.99 -43.38 98.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.058 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.66 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.005 0.431 . . . . 0.0 110.315 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 86' ' ' ILE . 36.2 mm -63.2 -43.05 98.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.521 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.61 -43.75 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.107 0.479 . . . . 0.0 110.227 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.5 ttm-85 -70.58 -55.15 9.51 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.683 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -52.99 -50.52 64.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.088 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.508 HG23 ' N ' ' A' ' 87' ' ' ALA . 4.0 tp -65.12 -45.74 93.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.034 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.508 ' N ' HG23 ' A' ' 86' ' ' ILE . . . -62.63 -36.53 83.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.444 -179.453 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -59.94 -48.65 80.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.572 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -66.58 -40.04 88.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.204 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 93' ' ' VAL . 82.0 mt -67.52 -35.06 78.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.891 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.5 -48.27 75.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.239 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -65.87 -52.8 47.13 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.124 -0.63 . . . . 0.0 110.573 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 90' ' ' LEU . 3.4 p -66.29 -26.47 38.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.628 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.93 -27.3 29.17 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -73.58 -47.38 41.01 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.798 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.0 m -71.02 -5.04 28.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.862 0.363 . . . . 0.0 110.766 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.2 ttt -62.4 -38.53 90.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -65.43 -33.33 75.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.4 ttt85 -55.58 -44.61 77.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.487 -179.341 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.6 m . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.167 179.687 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.532 ' N ' HD12 ' A' ' 105' ' ' LEU . 10.9 mp . . . . . 0 N--CA 1.461 0.124 0 CA-C-O 120.736 0.303 . . . . 0.0 110.578 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.553 HG13 ' N ' ' A' ' 107' ' ' ASN . 7.3 p -68.44 -47.04 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.724 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.553 ' N ' HG13 ' A' ' 106' ' ' VAL . 91.5 m-20 -68.98 -35.73 77.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.717 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -57.84 -15.94 22.11 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.83 -47.9 78.96 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.824 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.6 -38.54 80.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.5 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.81 -39.36 94.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.824 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.89 -47.74 76.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.65 -179.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.483 ' C ' ' N ' ' A' ' 115' ' ' ASN . 4.0 mm? -68.56 -42.31 78.52 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.374 179.155 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -47.7 -14.59 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.075 0.464 . . . . 0.0 110.481 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.483 ' N ' ' C ' ' A' ' 113' ' ' LEU . 93.9 m-20 -61.17 -40.72 94.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.395 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 t . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 121.13 0.491 . . . . 0.0 110.714 179.68 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 CA--C 1.521 -0.162 0 CA-C-O 120.465 0.174 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 58.0 mt -62.13 -35.76 79.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 120.639 0.256 . . . . 0.0 110.826 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -43.91 71.4 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.092 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.9 m -63.32 -47.66 81.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.239 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.58 -47.66 85.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.283 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.05 -40.44 97.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.446 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.47 -50.63 73.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.524 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -57.42 -44.7 84.87 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.702 -0.399 . . . . 0.0 109.962 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.91 -48.99 77.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.76 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.567 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.28 -42.2 86.04 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.94 -178.338 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 . . . . . 0 C--N 1.322 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.98 179.638 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 5.8 ptp . . . . . 0 N--CA 1.461 0.082 0 CA-C-O 120.928 0.394 . . . . 0.0 110.031 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -64.02 -49.34 72.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.443 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -65.85 -40.76 92.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.67 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.81 -35.3 76.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.417 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 150' ' ' VAL . 38.1 ttmt -72.02 -35.82 69.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.912 0.387 . . . . 0.0 110.45 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 77.4 m -59.74 -44.06 93.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.025 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 51.0 mtt -61.04 -45.33 95.2 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.492 -0.483 . . . . 0.0 109.737 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.72 -43.14 94.38 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.702 179.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 146' ' ' LYS . 47.3 t -62.1 -43.25 97.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.528 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.28 -44.42 88.46 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.315 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.47 90.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.004 0.43 . . . . 0.0 110.493 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 18.9 tp -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.448 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -47.81 84.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.453 . . . . 0.0 110.253 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.0 tp -67.14 -45.27 77.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.272 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.22 87.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.618 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.0 -37.81 83.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.286 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -62.54 -43.08 99.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.125 0.488 . . . . 0.0 110.509 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.8 t -67.15 -43.83 88.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.335 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.69 -35.63 80.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.897 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 29.5 m -159.84 161.99 34.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.379 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -98.56 -26.19 14.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.736 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 4.3 p 64.04 145.19 0.08 OUTLIER Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.494 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -71.67 155.66 58.5 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.466 2.111 . . . . 0.0 111.943 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 165' ' ' SER . . . . . 0.469 ' O ' ' N ' ' A' ' 167' ' ' LEU . 8.7 t . . . . . 0 C--N 1.328 -0.333 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.469 ' N ' ' O ' ' A' ' 165' ' ' SER . 53.7 mt . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 121.027 0.442 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -64.4 -45.83 85.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.553 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -66.12 -43.67 86.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.478 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 82.8 t -63.93 -44.94 98.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.348 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -61.0 -41.34 96.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.45 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -63.45 -49.68 72.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.815 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 16.4 m -61.74 -42.6 99.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.806 0.336 . . . . 0.0 110.432 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.7 m -53.87 -44.09 70.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.585 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.4 t -64.29 -42.12 94.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.807 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 46.3 t30 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.267 179.642 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.431 ' O ' HG12 ' A' ' 186' ' ' VAL . 55.5 mt . . . . . 0 N--CA 1.453 -0.323 0 CA-C-O 120.507 0.194 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -51.0 -42.15 60.17 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.154 -177.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 85.5 m -72.36 -51.49 20.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.793 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -63.68 -49.35 73.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.385 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 186' ' ' VAL . . . . . 0.431 HG12 ' O ' ' A' ' 182' ' ' LEU . 3.0 p -58.41 -35.01 52.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.148 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 59.5 ttt85 -59.68 -52.28 66.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.903 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 78.2 p -58.73 -48.71 80.22 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.694 -179.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 10.9 mp . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.525 179.582 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.6 t . . . . . 0 N--CA 1.457 -0.111 0 CA-C-O 120.903 0.382 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -65.06 -30.49 71.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.772 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -38.84 82.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.538 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -63.05 -42.36 99.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.464 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.59 -44.78 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.415 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.4 mt -63.22 -43.66 98.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.92 0.391 . . . . 0.0 110.179 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.414 ' HG2' ' HE ' ' A' ' 88' ' ' ARG . 44.8 ttm180 -52.58 -54.42 33.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.825 -179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.526 ' ND2' ' NE2' ' A' ' 89' ' ' HIS . 14.9 t-20 -57.51 -40.94 79.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 110.672 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.4 mt -60.24 -52.87 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.277 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.54 72.69 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.117 0.484 . . . . 0.0 110.478 -179.38 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ARG . . . . . 0.414 ' HE ' ' HG2' ' A' ' 84' ' ' ARG . 93.9 mtt-85 -61.08 -44.38 97.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.474 179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.526 ' NE2' ' ND2' ' A' ' 85' ' ' ASN . 77.7 m-70 -66.38 -44.03 84.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.934 0.397 . . . . 0.0 110.648 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.3 mp -69.23 -35.09 75.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.572 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.52 -47.96 83.51 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.596 -179.56 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -67.79 -52.44 37.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.344 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.4 t -66.86 -27.22 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.561 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -65.83 -39.55 95.15 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.42 -44.89 95.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.893 0.377 . . . . 0.0 110.632 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.455 ' C ' ' N ' ' A' ' 98' ' ' ASP . 68.9 m -77.32 -3.44 39.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.73 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.4 ttm -49.79 -13.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.455 ' N ' ' C ' ' A' ' 96' ' ' SER . 88.9 m-20 -66.18 -11.25 48.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.505 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -73.51 -66.04 0.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.612 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 CA--C 1.515 -0.397 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.47 179.977 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.272 0 CA-C-O 121.179 0.514 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.411 ' H ' HG22 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -70.34 -44.57 77.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.024 179.157 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 56.5 t-20 -57.01 -50.0 74.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.348 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -70.42 -46.56 48.01 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.427 ' O ' ' N ' ' A' ' 113' ' ' LEU . 47.2 tp -52.18 -47.75 65.37 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.929 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.32 74.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.275 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.414 ' O ' ' N ' ' A' ' 115' ' ' ASN . 82.4 mt -67.48 -46.88 71.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.005 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -64.4 -33.39 75.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.228 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 109' ' ' LEU . 53.6 tp -66.54 -39.26 88.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.945 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -91.17 -21.89 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.884 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 111' ' ' LEU . 96.7 m-20 -88.67 4.0 48.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 54.0 m . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.988 179.742 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.555 0.217 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.5 mt -67.48 -43.56 80.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.804 0.335 . . . . 0.0 110.93 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.02 -32.78 74.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.436 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 21.4 m -62.33 -52.66 62.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.324 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.53 88.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.33 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.7 tp -62.0 -48.69 79.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.25 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -59.33 -35.02 73.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.239 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -63.63 -40.48 97.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.594 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.0 tp -62.13 -44.34 96.85 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.619 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 135' ' ' LEU . 9.7 mp -74.83 -32.41 61.93 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.658 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 -179.26 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 74.6 mtm . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 120.768 0.318 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.517 ' OE1' ' N ' ' A' ' 144' ' ' LYS . 7.1 tm-20 -70.71 -47.0 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' LYS . . . . . 0.517 ' N ' ' OE1' ' A' ' 143' ' ' GLU . 10.4 tptm -62.71 -48.42 79.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.841 -179.189 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.54 -50.78 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.355 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' LYS . . . . . 0.416 ' O ' HG23 ' A' ' 150' ' ' VAL . 55.3 mtpt -63.48 -39.06 93.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.533 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 74.9 m -59.89 -46.86 88.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.567 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.6 mtm -64.58 -41.9 95.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.585 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 78.0 mt -63.69 -44.26 94.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.968 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 146' ' ' LYS . 72.4 t -66.93 -43.14 89.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.432 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 55.4 tp -59.11 -46.6 87.89 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.474 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.6 -38.81 90.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.263 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.7 tp -63.68 -41.26 98.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.463 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 64.8 mt -60.22 -43.09 96.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.208 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.35 -41.84 98.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.242 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.87 -33.45 70.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.256 0.551 . . . . 0.0 110.502 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -72.46 -44.2 62.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.343 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.06 -48.2 77.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.489 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 160' ' ' ALA . 14.9 p -62.18 -36.84 76.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.249 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 160' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -60.97 -51.35 69.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.625 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 161' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 23.7 p -24.14 141.47 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.793 0.683 . . . . 0.0 110.684 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 162' ' ' HIS . . . . . 0.57 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.5 m-70 168.51 -38.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.36 156.68 75.97 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.384 -179.495 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.98 144.61 88.29 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.61 2.206 . . . . 0.0 111.713 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 85.0 p . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 179.655 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 54.3 tp . . . . . 0 N--CA 1.454 -0.234 0 CA-C-O 120.793 0.33 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -65.39 -39.42 92.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.628 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 169' ' ' ASP . . . . . 0.449 ' O ' HG23 ' A' ' 173' ' ' THR . 99.7 m-20 -62.88 -46.63 86.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.997 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.477 ' O ' ' OG1' ' A' ' 173' ' ' THR . 77.1 t -64.3 -44.28 97.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.228 0.537 . . . . 0.0 110.17 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -57.62 -45.56 85.23 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.238 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -65.51 -41.88 92.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.86 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 173' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 18.6 p -58.82 -46.59 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.325 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.42 -43.96 88.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.029 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.9 t -59.71 -43.4 91.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.193 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.655 -179.586 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 182' ' ' LEU . . . . . 0.524 HD22 ' N ' ' A' ' 182' ' ' LEU . 4.1 mm? . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.741 0.305 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 183' ' ' ARG . . . . . 0.583 HH12 ' NH1' ' A' ' 187' ' ' ARG . 73.8 ttt-85 -53.82 -41.37 67.27 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.379 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -60.29 -51.98 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.644 -179.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -67.92 -39.57 83.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.745 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.08 -42.47 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.705 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 187' ' ' ARG . . . . . 0.583 ' NH1' HH12 ' A' ' 183' ' ' ARG . 62.3 ttp180 -60.28 -45.23 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.773 -179.078 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 36.2 t -58.89 -51.22 70.96 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.762 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 189' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 189' ' ' LEU . 4.0 mm? . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.674 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -89.9 -0.67 57.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.776 0.322 . . . . 0.0 110.431 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.515 ' O ' ' N ' ' A' ' 65' ' ' SER . 60.0 ttm-85 -64.04 -42.72 96.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.199 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 65' ' ' SER . 31.6 t 49.11 -87.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.674 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 63' ' ' ARG . 8.4 p 59.76 134.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.885 0.374 . . . . 0.0 110.566 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -100.62 108.91 20.93 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.417 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.2 p -136.86 3.65 2.72 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.516 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -80.78 42.51 0.63 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.741 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.99 -41.92 99.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.194 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 67.16 -174.54 26.25 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -83.03 143.19 30.78 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.523 ' O ' ' N ' ' A' ' 74' ' ' ALA . 9.9 tp -134.71 136.6 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 CA-C-O 121.001 0.429 . . . . 0.0 110.275 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -41.49 90.8 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.798 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.523 ' N ' ' O ' ' A' ' 72' ' ' ILE . . . -175.21 -31.46 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.71 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -92.37 11.92 24.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.784 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.6 t -59.03 -43.23 91.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.555 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -59.84 135.82 57.81 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.2 m 60.38 86.5 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.953 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -58.88 -30.97 68.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.341 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.82 -35.15 79.68 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.195 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -62.78 -34.42 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.2 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.47 -43.76 98.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.349 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.87 -44.12 98.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -58.06 -44.51 87.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.112 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.96 -44.49 92.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 0.0 109.98 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.2 mt -61.58 -42.31 93.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.569 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.84 -51.49 68.79 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -52.31 -44.12 64.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.327 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -60.61 -50.75 72.25 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.99 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.549 ' O ' ' N ' ' A' ' 94' ' ' GLY . 11.7 mt -57.81 -38.32 75.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.974 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.81 74.13 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -57.52 -50.95 71.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.198 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.2 t -71.42 -26.23 26.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 121.229 0.538 . . . . 0.0 110.483 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.14 -28.57 68.06 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.216 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 98' ' ' ASP . 92.6 m-20 -68.79 -37.86 79.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.746 0.308 . . . . 0.0 111.139 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.1 t -71.25 -12.76 61.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.513 -179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 89.8 mmm -71.46 -10.42 59.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.732 0.301 . . . . 0.0 110.974 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' A' ' 95' ' ' ASP . 42.1 p-10 -98.59 8.52 44.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.731 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -155.79 38.44 0.37 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.918 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 56.7 p -144.22 -24.48 0.54 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.869 0.366 . . . . 0.0 110.431 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.625 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 0.8 OUTLIER -94.96 -37.02 0.29 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.71 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.625 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 44.0 Cg_endo -85.5 163.2 10.99 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 C-N-CA 122.167 1.911 . . . . 0.0 112.81 -178.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.24 -40.07 78.71 Favored 'Trans proline' 0 N--CA 1.494 1.5 0 C-N-CA 122.099 1.866 . . . . 0.0 111.396 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.52 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . 125.21 149.57 7.56 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.731 HD12 ' N ' ' A' ' 105' ' ' LEU . 6.3 mp 54.93 3.45 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.729 0.3 . . . . 0.0 111.046 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.52 ' H ' ' C ' ' A' ' 104' ' ' GLY . 7.2 p -60.17 -33.74 54.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.607 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.6 t-20 -69.15 -50.14 50.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.107 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.89 -48.89 18.27 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.23 -44.15 96.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.808 0.337 . . . . 0.0 110.262 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.553 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.5 tp -66.27 -44.69 82.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.99 0.424 . . . . 0.0 110.55 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -67.62 -35.04 78.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.467 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.1 tp -60.78 -42.69 98.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.59 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -65.88 -39.29 90.54 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.746 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -62.83 -44.68 95.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.582 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 97.3 m -66.26 -46.25 77.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.023 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.499 ' O ' ' N ' ' A' ' 119' ' ' SER . 23.2 t -86.34 16.98 3.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.689 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -64.54 70.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.351 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.499 ' N ' ' O ' ' A' ' 117' ' ' SER . 54.6 p -136.83 4.9 2.82 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.539 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.408 ' O ' ' O ' ' A' ' 121' ' ' GLU . 97.6 mt-10 -141.16 -158.98 0.91 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.185 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.506 ' C ' ' H ' ' A' ' 123' ' ' ARG . 97.7 mt-10 55.58 165.86 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.189 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.0 t0 69.34 -38.49 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.697 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.506 ' H ' ' C ' ' A' ' 121' ' ' GLU . 78.3 mtp85 -63.55 -41.11 98.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.742 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.495 ' OD1' ' N ' ' A' ' 125' ' ' ARG . 13.9 p30 -87.29 -32.41 19.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.027 0.441 . . . . 0.0 110.556 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.495 ' N ' ' OD1' ' A' ' 124' ' ' ASN . 4.1 ttt180 -86.34 9.25 18.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.406 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.528 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 21.3 p-10 -64.3 -71.23 0.18 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.791 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 54.9 mt -62.61 -35.73 80.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.545 0.212 . . . . 0.0 111.009 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.82 -41.36 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.324 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.5 m -61.77 -44.47 96.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.03 0.443 . . . . 0.0 110.15 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -46.58 80.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.6 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.88 -42.81 99.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.96 -52.84 37.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -59.63 -47.88 83.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.364 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.16 -48.8 76.91 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.268 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.24 -42.62 99.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? -57.56 -41.2 80.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -107.21 72.12 0.86 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.51 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.484 ' O ' ' CD2' ' A' ' 138' ' ' TYR . 74.7 t80 -132.46 60.09 48.13 Favored Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.331 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.455 ' O ' ' O ' ' A' ' 140' ' ' ARG . 51.6 Cg_endo -71.4 -33.36 11.14 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 C-N-CA 122.59 2.193 . . . . 0.0 111.8 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.455 ' O ' ' O ' ' A' ' 139' ' ' PRO . 56.2 ttt-85 55.8 157.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.568 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.56 ' C ' ' H ' ' A' ' 143' ' ' GLU . 1.7 m-20 -62.22 -42.82 99.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.482 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 70.0 mtp 65.32 -20.1 0.09 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.031 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.56 ' H ' ' C ' ' A' ' 141' ' ' ASP . 11.1 mt-10 -65.66 -43.79 88.29 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-O 120.876 0.37 . . . . 0.0 110.485 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -63.67 -31.03 72.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.776 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -75.86 -50.67 14.42 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.221 0.534 . . . . 0.0 110.924 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -68.25 -42.07 80.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.603 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.416 ' CB ' ' O ' ' A' ' 143' ' ' GLU . 99.6 m -62.15 -42.51 99.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.389 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 42.0 ttm -59.27 -46.33 88.81 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.65 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.3 -50.31 54.45 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.945 -0.702 . . . . 0.0 110.409 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -42.92 95.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.298 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.405 ' CB ' ' O ' ' A' ' 147' ' ' THR . 48.4 tp -60.93 -43.84 98.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.307 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.76 98.22 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.156 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 51.9 tp -60.62 -41.86 95.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.8 -41.76 96.28 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.103 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.416 ' O ' HG23 ' A' ' 159' ' ' VAL . 56.2 tp -62.33 -47.12 85.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.955 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.52 79.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -61.42 -45.83 92.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.384 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.86 -38.99 93.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.51 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 155' ' ' LEU . 83.4 t -66.58 -44.46 89.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.316 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.33 -39.52 92.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.187 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 64.0 m -164.55 167.16 19.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.162 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.445 ' O ' ' C ' ' A' ' 163' ' ' THR . 33.2 m170 -112.63 115.55 28.76 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.445 ' C ' ' O ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER -29.39 93.55 0.05 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.442 0.464 . . . . 0.0 111.207 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 162' ' ' HIS . 32.5 Cg_exo -55.16 143.69 73.47 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 121.875 1.716 . . . . 0.0 112.291 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 11.0 p -71.41 -170.93 0.56 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.828 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 37.1 mt 67.48 -59.24 0.41 Allowed 'General case' 0 N--CA 1.462 0.174 0 O-C-N 123.56 0.538 . . . . 0.0 110.502 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 50.2 mt -64.06 -35.56 81.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.356 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -64.35 -47.09 80.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.9 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.23 -46.74 85.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.393 . . . . 0.0 110.677 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.1 -44.84 97.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.322 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.45 -43.12 97.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -57.34 -48.89 77.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.721 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 17.7 m -59.9 -47.09 87.17 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.5 m -53.48 -43.06 67.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.117 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.4 t -61.48 -40.86 87.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.326 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -59.53 -40.04 85.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.856 0.36 . . . . 0.0 110.417 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -61.45 -47.95 83.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.887 0.375 . . . . 0.0 110.491 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 96.8 mt -69.32 -36.61 73.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.706 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 56.3 m-20 -49.46 -33.79 15.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.853 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -52.65 148.3 7.41 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.344 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 48.9 t30 70.97 -55.59 0.64 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.064 0.459 . . . . 0.0 110.282 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 74.5 mt -61.71 -36.0 79.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.646 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 183' ' ' ARG . . . . . 0.431 ' O ' ' CB ' ' A' ' 187' ' ' ARG . 39.2 mmt-85 -54.37 -31.33 54.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.539 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.6 m -58.15 -47.92 81.84 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.555 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -73.42 -48.1 36.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.003 0.43 . . . . 0.0 111.001 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 86.0 t -62.17 -44.6 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.772 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 187' ' ' ARG . . . . . 0.431 ' CB ' ' O ' ' A' ' 183' ' ' ARG . 77.9 ttt-85 -62.22 -44.02 97.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.482 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 188' ' ' SER . . . . . 0.49 ' O ' ' ND2' ' A' ' 192' ' ' ASN . 68.7 m -60.34 -40.76 91.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.886 0.374 . . . . 0.0 110.316 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 53.7 tp -64.06 -42.33 97.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 190' ' ' ALA . . . . . 0.432 ' O ' ' ND2' ' A' ' 192' ' ' ASN . . . -74.88 156.08 36.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.958 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 51.09 37.61 18.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.475 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.49 ' ND2' ' O ' ' A' ' 188' ' ' SER . 72.2 m-80 -154.86 153.14 30.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -79.46 -153.83 8.19 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 70.4 mmm -63.14 -40.09 96.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.654 0.264 . . . . 0.0 110.424 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.7 p-10 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.548 179.961 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -62.89 -41.64 99.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.341 . . . . 0.0 110.551 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -76.9 134.72 38.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.561 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.6 t 53.55 89.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.61 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.2 t -70.56 151.53 44.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.601 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.502 ' NE2' ' O ' ' A' ' 68' ' ' ARG . 80.8 t60 -67.95 132.49 47.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.379 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 32.0 t -141.96 46.6 1.65 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.445 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.502 ' O ' ' NE2' ' A' ' 66' ' ' HIS . 78.9 ttt-85 -156.13 87.01 1.04 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.346 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.91 144.96 43.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.313 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.16 169.58 13.3 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.434 ' O ' ' N ' ' A' ' 73' ' ' GLU . 22.6 mmt85 -64.02 -39.98 95.32 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.709 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.43 ' CG1' ' O ' ' A' ' 72' ' ' ILE . 3.9 tt 35.56 33.44 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 121.225 0.536 . . . . 0.0 111.264 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 71' ' ' ARG . 94.1 mt-10 -143.42 -59.07 0.41 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.824 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 75' ' ' ASP . . . -58.22 -23.36 55.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.46 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 77' ' ' GLU . 74.2 m-20 -58.87 -130.04 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.593 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.3 t 63.38 -67.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.719 0.295 . . . . 0.0 110.736 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 75' ' ' ASP . 45.1 mt-10 -59.84 -43.12 94.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.383 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.3 p -64.01 -33.48 75.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.723 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 68.22 -60.16 0.42 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.612 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.433 ' HB3' HH12 ' A' ' 84' ' ' ARG . 14.6 mm-40 -61.24 -33.75 74.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.378 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.433 ' OD2' ' OD1' ' A' ' 75' ' ' ASP . 32.8 t0 -58.4 -28.56 65.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.205 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.7 mt -60.91 -47.33 93.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.231 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.35 -45.1 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.433 HH12 ' HB3' ' A' ' 80' ' ' GLU . 84.1 mtt85 -55.82 -44.47 77.92 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.975 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -63.7 -45.09 91.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.017 0.437 . . . . 0.0 110.41 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.6 mt -58.17 -44.58 87.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.105 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.75 93.85 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.425 -0.51 . . . . 0.0 109.813 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -52.6 -45.56 66.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.047 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -46.59 89.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.155 0.502 . . . . 0.0 110.307 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.0 mp -62.22 -39.57 93.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.074 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.08 -41.32 78.6 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.017 0.437 . . . . 0.0 110.229 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -63.19 -51.9 64.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.111 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.91 -26.36 30.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.245 0.545 . . . . 0.0 110.342 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -73.64 -41.63 42.66 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -63.95 -42.97 97.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.775 0.322 . . . . 0.0 110.632 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 98' ' ' ASP . 51.1 m -57.09 -39.48 75.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.427 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.04 60.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.293 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.458 ' OD1' ' CD ' ' A' ' 103' ' ' PRO . 67.6 t0 -169.72 42.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.418 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -131.84 -38.38 1.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t -101.59 0.58 36.61 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.857 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.64 ' O ' HG23 ' A' ' 101' ' ' ILE . 19.7 tt -138.34 62.04 28.76 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.018 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -36.72 98.53 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.332 0 C-N-CA 122.509 2.139 . . . . 0.0 111.632 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.458 ' CD ' ' OD1' ' A' ' 98' ' ' ASP . 69.4 Cg_endo -83.67 -82.22 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.369 2.046 . . . . 0.0 112.513 -179.027 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.481 ' O ' ' N ' ' A' ' 108' ' ' GLY . . . -45.2 -36.31 5.37 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 105' ' ' LEU . 10.9 mp -60.59 -64.56 0.91 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.075 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 85.6 t -64.32 -46.15 93.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.974 0.416 . . . . 0.0 110.732 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -63.38 -50.34 70.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.883 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 104' ' ' GLY . . . -60.71 -32.95 80.62 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.2 tp -61.54 -46.41 90.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -54.96 -48.93 72.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.117 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.427 HD12 ' N ' ' A' ' 111' ' ' LEU . 11.2 mp -65.84 -39.2 90.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.488 178.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.34 -45.26 91.86 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.124 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.4 tp -63.65 -42.59 98.09 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.699 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.66 HH12 ' NH2' ' A' ' 118' ' ' ARG . 59.2 ttm-85 -75.2 -42.89 54.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.009 0.433 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -44.92 -17.55 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.171 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.479 ' N ' ' O ' ' A' ' 114' ' ' ARG . 16.4 m -59.23 -47.7 84.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 119' ' ' SER . 18.7 m -163.64 -137.56 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.052 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.66 ' NH2' HH12 ' A' ' 114' ' ' ARG . 72.2 mtp180 57.17 -78.93 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.605 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 117' ' ' SER . 29.7 t -82.83 -172.48 4.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.376 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.505 ' N ' ' OG ' ' A' ' 119' ' ' SER . 93.8 mt-10 59.44 9.06 1.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.504 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.467 ' C ' ' N ' ' A' ' 123' ' ' ARG . 75.9 mm-40 -105.67 179.93 4.12 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.71 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 50.2 p-10 -47.03 -16.49 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.459 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.467 ' N ' ' C ' ' A' ' 121' ' ' GLU . 62.1 ttm-85 -61.24 -44.52 97.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.559 ' O ' ' N ' ' A' ' 126' ' ' ASP . 61.6 t-20 -120.41 -73.24 0.65 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.814 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -51.84 85.23 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.165 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.559 ' N ' ' O ' ' A' ' 124' ' ' ASN . 66.6 t0 -173.43 -102.15 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.525 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.1 mt -50.32 -38.19 40.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.451 -178.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.81 -48.95 69.36 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.26 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.3 m -60.94 -42.78 98.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.574 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.52 -47.94 78.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.346 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.91 -41.59 87.62 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.459 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -55.44 -51.41 67.01 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.941 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -53.99 -47.73 71.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.678 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.21 -43.53 94.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.442 . . . . 0.0 109.966 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.55 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -56.4 -46.88 79.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.498 -178.079 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -55.77 -25.43 40.88 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.569 -0.452 . . . . 0.0 109.96 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.67 74.8 1.4 Allowed 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.775 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.662 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 12.3 t80 -90.28 -32.75 0.37 Allowed Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.775 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.662 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 51.3 Cg_exo -52.7 81.69 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.856 1.704 . . . . 0.0 112.359 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' A' ' 138' ' ' TYR . 13.7 ptm180 -155.59 159.25 39.5 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.765 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 54.91 34.6 22.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.63 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.6 ttp -160.46 -71.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.624 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -65.33 -35.12 80.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 26.9 tptt -61.53 -47.64 84.66 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.837 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.498 ' O ' HD13 ' A' ' 149' ' ' LEU . 80.5 mm-40 -64.01 -41.75 97.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.825 0.345 . . . . 0.0 110.569 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.526 ' O ' HG23 ' A' ' 150' ' ' VAL . 31.2 ttpt -58.29 -42.24 86.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.45 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.1 m -60.19 -46.84 88.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.709 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.2 mtm -64.59 -41.53 96.19 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.749 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 145' ' ' GLU . 7.7 mp -63.99 -41.1 97.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.727 0.299 . . . . 0.0 110.626 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 146' ' ' LYS . 53.8 t -60.83 -45.06 98.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.476 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.2 tp -61.39 -45.41 94.49 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.463 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.94 -37.0 86.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.639 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.87 -41.92 99.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.417 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.02 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.18 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.42 ' O ' HG23 ' A' ' 159' ' ' VAL . 91.4 mt -61.39 -43.31 99.08 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.023 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -71.65 -46.62 58.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.47 179.206 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.97 -37.46 87.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.507 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -61.07 -44.55 97.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.596 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 155' ' ' LEU . 53.1 t -60.17 -48.81 86.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.323 -179.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.14 -38.54 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.952 0.406 . . . . 0.0 110.955 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' SER . . . . . 0.564 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 29.4 t -72.04 -165.57 0.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.416 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.564 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.9 m-70 167.38 89.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.119 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.1 p -123.74 152.98 66.64 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.584 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -68.03 156.36 66.14 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.489 2.126 . . . . 0.0 111.7 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 83.8 p -94.24 -6.5 44.45 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.624 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 56.7 mt -63.77 -50.33 69.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.794 0.33 . . . . 0.0 111.07 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.539 HD22 ' N ' ' A' ' 167' ' ' LEU . 3.9 mm? -67.92 -38.37 82.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.519 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -61.87 -38.02 86.72 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.42 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -62.72 -46.89 85.99 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.557 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.0 t -66.63 -48.92 78.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.049 0.452 . . . . 0.0 110.143 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -56.23 -39.46 72.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.628 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -61.56 -41.37 97.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.687 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 99.3 m -59.54 -46.59 88.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.551 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 81.7 m -57.88 -43.71 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.029 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.9 t -56.67 -43.79 79.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.721 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.4 -38.23 88.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.771 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -56.62 -46.05 81.17 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.758 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.412 HD12 ' N ' ' A' ' 178' ' ' ILE . 2.1 mp -62.38 -38.36 81.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -60.35 -33.71 72.81 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.882 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 182' ' ' LEU . 50.9 tt0 -83.92 118.13 23.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.431 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 62.16 -57.95 0.13 Allowed 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.502 ' N ' ' O ' ' A' ' 180' ' ' GLN . 11.1 mp -48.43 -35.84 13.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.169 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 183' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 187' ' ' ARG . 61.0 ttt85 -51.51 -43.28 62.2 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.498 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -63.44 -52.3 62.04 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.749 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -68.5 -41.0 80.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.833 0.349 . . . . 0.0 111.282 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 189' ' ' LEU . 40.7 t -62.76 -45.77 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.552 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 187' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 183' ' ' ARG . 64.5 ttm-85 -60.56 -52.54 64.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.42 -178.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 79.8 p -63.72 -38.95 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.726 0.298 . . . . 0.0 110.616 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.466 ' O ' ' O ' ' A' ' 190' ' ' ALA . 54.7 tp -82.78 124.94 30.74 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.308 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 190' ' ' ALA . . . . . 0.466 ' O ' ' O ' ' A' ' 189' ' ' LEU . . . 54.61 112.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.564 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -62.82 135.0 57.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.43 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -97.84 11.1 38.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.308 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -59.72 156.17 28.16 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 50.9 ttp -84.6 128.9 34.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.799 0.333 . . . . 0.0 110.543 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.6 t0 . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.836 179.799 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.352 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.7 p-10 -81.39 -6.85 59.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.767 0.318 . . . . 0.0 110.628 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -149.86 161.07 43.0 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.562 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 62.3 p -151.37 110.04 3.83 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.453 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 52.5 m -61.7 -42.49 99.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.562 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -143.42 146.73 33.7 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.497 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.1 p -102.25 76.11 1.55 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.497 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -92.73 6.12 48.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.692 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.604 HD12 ' N ' ' A' ' 69' ' ' LEU . 9.6 mp -77.71 133.01 38.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.192 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -154.38 -50.07 0.01 OUTLIER Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.439 ' O ' ' O ' ' A' ' 72' ' ' ILE . 84.0 mtp180 -91.65 -2.24 57.14 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.88 0.371 . . . . 0.0 110.493 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.624 HG22 ' N ' ' A' ' 73' ' ' GLU . 82.8 mt 54.34 166.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.364 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.624 ' N ' HG22 ' A' ' 72' ' ' ILE . 0.1 OUTLIER 79.77 -34.18 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.281 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -82.25 2.41 32.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.453 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -79.86 22.41 0.49 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.567 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 92.5 p -55.65 -26.12 42.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.284 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -65.69 -22.95 66.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.284 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.0 p -63.54 -19.99 65.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.481 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.38 -9.47 56.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.18 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -71.34 -37.0 71.74 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.434 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.35 -51.48 69.32 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.281 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.406 HG23 ' N ' ' A' ' 83' ' ' ILE . 12.9 tt -65.18 -41.3 91.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.094 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.406 ' N ' HG23 ' A' ' 82' ' ' ILE . 73.6 mt -63.09 -42.35 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.171 178.371 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -55.72 -48.77 74.6 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.623 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -60.84 -41.79 96.53 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.515 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.01 -44.63 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.897 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.85 -46.28 78.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.803 0.335 . . . . 0.0 110.35 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 95.2 mtm-85 -56.25 -43.52 78.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.649 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -64.12 -45.54 88.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.085 0.469 . . . . 0.0 110.475 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.05 -35.69 80.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.204 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.51 82.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.712 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.95 -52.52 55.84 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.529 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.73 -25.93 31.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.758 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.546 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -84.44 -35.34 14.42 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.318 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -65.15 -47.15 78.07 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.537 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 29.8 t -166.0 152.63 9.54 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.725 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.7 tpt -154.93 128.72 8.67 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.144 0.497 . . . . 0.0 110.602 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.733 ' O ' HG22 ' A' ' 101' ' ' ILE . 89.7 m-20 40.09 65.04 0.79 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.226 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.487 ' C ' ' H ' ' A' ' 101' ' ' ILE . 90.1 mtm180 -38.02 -24.07 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.188 0.518 . . . . 0.0 110.598 -179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 98' ' ' ASP . 26.8 t -73.08 17.86 0.12 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.628 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.733 HG22 ' O ' ' A' ' 98' ' ' ASP . 18.8 tt -131.64 53.9 12.84 Favored Pre-proline 0 N--CA 1.468 0.459 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.281 -179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.461 ' O ' HG12 ' A' ' 106' ' ' VAL . 85.4 Cg_exo -32.16 94.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.78 2.32 . . . . 0.0 112.159 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -84.29 -86.92 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.153 1.902 . . . . 0.0 111.874 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.541 ' O ' ' N ' ' A' ' 108' ' ' GLY . . . -65.24 -23.48 69.93 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.094 -0.802 . . . . 0.0 111.094 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.443 ' N ' ' CD2' ' A' ' 105' ' ' LEU . 4.0 mm? -59.68 -71.03 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.63 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 107' ' ' ASN . 12.7 p -61.17 -43.77 97.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.643 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.56 ' N ' HG13 ' A' ' 106' ' ' VAL . 50.2 t-20 -65.84 -36.4 83.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.0 110.489 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 104' ' ' GLY . . . -47.99 -26.04 4.18 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.516 ' N ' HD22 ' A' ' 109' ' ' LEU . 4.0 mm? -62.66 -43.48 98.69 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.022 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.06 -40.09 69.95 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.893 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 50.6 tp -66.69 -41.47 88.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.708 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -54.68 -42.78 71.83 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.31 -40.44 97.34 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.435 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -74.06 -28.12 61.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.421 . . . . 0.0 110.596 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.538 ' O ' ' NE ' ' A' ' 118' ' ' ARG . 93.7 m-20 -63.57 -41.88 98.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 t -73.38 -33.7 65.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.696 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.574 ' C ' ' H ' ' A' ' 119' ' ' SER . 92.6 p -54.69 -82.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.738 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.538 ' NE ' ' O ' ' A' ' 115' ' ' ASN . 82.1 mtt-85 65.51 -34.24 0.18 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.017 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.574 ' H ' ' C ' ' A' ' 117' ' ' SER . 32.4 t -63.21 -42.92 99.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.008 0.433 . . . . 0.0 110.847 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -64.42 -41.46 96.59 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.526 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -87.44 -172.45 3.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.116 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.767 ' H ' ' HE ' ' A' ' 125' ' ' ARG . 98.3 m-20 57.99 40.22 25.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.738 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -126.46 -57.17 1.38 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.623 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -85.11 -41.71 15.45 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.939 0.4 . . . . 0.0 110.921 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.767 ' HE ' ' H ' ' A' ' 122' ' ' ASP . 26.6 ptt180 -74.27 -7.41 52.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.297 -179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 25.6 p-10 -48.23 -71.04 0.07 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.331 -179.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.544 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 51.9 mt -67.1 -34.24 77.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 110.812 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -39.39 66.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.1 m -62.03 -47.35 85.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.433 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.72 -43.59 94.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.946 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.28 -41.7 98.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 110.476 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -60.31 -46.58 89.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.358 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.46 -52.65 63.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.65 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.24 -49.49 73.94 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.157 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 56.7 tp -57.19 -38.08 73.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.274 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -57.15 -27.48 61.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.261 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -135.27 60.24 1.7 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.001 0.429 . . . . 0.0 110.906 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.646 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 17.0 t80 -90.1 -32.27 0.37 Allowed Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.768 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.646 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 51.1 Cg_exo -53.0 85.76 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.891 1.727 . . . . 0.0 112.235 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 138' ' ' TYR . 14.3 ptm180 -148.32 153.02 38.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.803 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 49.55 51.99 15.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.459 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 38.8 ttm -105.48 -32.69 8.41 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.452 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.407 ' O ' ' OG1' ' A' ' 147' ' ' THR . 43.5 tp10 -67.16 -35.07 78.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.73 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.58 -31.58 69.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.725 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -69.05 -47.95 64.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.148 0.499 . . . . 0.0 110.815 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.419 ' O ' HG23 ' A' ' 150' ' ' VAL . 53.8 mtmt -67.24 -38.13 84.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.721 178.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 10.2 m -58.55 -43.27 89.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.113 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.5 mtt -61.41 -46.4 90.29 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.04 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.6 mp -65.71 -45.85 81.21 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 119.622 -0.831 . . . . 0.0 110.466 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 146' ' ' LYS . 64.9 t -60.53 -42.54 91.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 -179.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 27.1 mt -60.01 -42.59 94.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.036 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.73 -43.74 95.62 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.174 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.567 HD11 ' NZ ' ' A' ' 157' ' ' LYS . 38.0 tp -60.72 -42.31 97.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.0 mt -61.25 -43.43 98.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.049 0.452 . . . . 0.0 110.158 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.422 ' O ' HG23 ' A' ' 159' ' ' VAL . 88.9 mt -63.41 -44.09 95.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.054 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.23 -35.46 76.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.567 ' NZ ' HD11 ' A' ' 153' ' ' LEU . 26.8 mmtm -60.27 -48.99 79.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.044 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -67.31 -40.75 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.022 0.439 . . . . 0.0 110.897 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 155' ' ' LEU . 71.1 t -67.71 -44.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.535 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.75 96.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' SER . . . . . 0.421 ' O ' ' O ' ' A' ' 157' ' ' LYS . 25.8 t -173.51 179.2 2.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.351 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -128.42 143.94 51.07 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.063 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.4 p -78.36 150.05 76.37 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.607 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.48 156.34 61.67 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.26 1.974 . . . . 0.0 112.012 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' SER . . . . . 0.401 ' O ' ' CB ' ' A' ' 166' ' ' LEU . 72.3 m -85.45 179.93 7.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.381 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.429 HD13 ' O ' ' A' ' 166' ' ' LEU . 0.2 OUTLIER 76.73 -59.41 0.49 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.654 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.549 HD12 ' N ' ' A' ' 167' ' ' LEU . 9.0 mp -62.64 -26.02 68.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.088 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.45 -42.64 99.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.14 -45.79 86.96 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.996 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.69 -44.53 96.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.467 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.88 -41.9 92.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.284 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.96 -48.71 80.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.612 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.8 m -59.3 -46.73 87.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.078 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.6 m -52.94 -43.11 66.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.986 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.4 t -61.04 -44.98 99.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.366 179.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -72.13 -30.76 65.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.024 0.44 . . . . 0.0 110.464 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -58.15 -41.04 82.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.58 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.8 mt -60.31 -42.52 90.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.599 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -49.81 -34.53 19.88 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.787 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -49.37 -88.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.468 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -88.4 58.1 4.55 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.304 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp -61.72 -40.29 94.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.715 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 183' ' ' ARG . . . . . 0.421 ' HD3' ' H ' ' A' ' 183' ' ' ARG . 0.7 OUTLIER -61.47 -45.65 93.37 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 18.9 m -58.0 -46.64 84.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.855 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -54.19 -41.97 69.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.61 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 70.9 t -60.3 -50.83 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.284 -0.567 . . . . 0.0 110.246 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -67.85 -33.83 75.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.274 0.559 . . . . 0.0 110.475 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 35.2 t -58.04 -44.08 87.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.172 -179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.68 HD23 ' N ' ' A' ' 190' ' ' ALA . 1.0 OUTLIER -172.75 135.27 0.64 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.365 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 190' ' ' ALA . . . . . 0.68 ' N ' HD23 ' A' ' 189' ' ' LEU . . . -54.91 78.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 191' ' ' ARG . . . . . 0.597 ' N ' ' O ' ' A' ' 189' ' ' LEU . 79.7 ttt-85 -92.31 -97.91 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.285 -179.379 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 53.53 35.48 20.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.788 0.328 . . . . 0.0 110.618 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 193' ' ' GLY . . . . . 0.44 ' H ' ' HG2' ' A' ' 191' ' ' ARG . . . 177.24 -168.54 40.35 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 194' ' ' MET . . . . . 0.501 ' O ' ' NH2' ' A' ' 191' ' ' ARG . 0.0 OUTLIER 53.96 109.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.928 0.394 . . . . 0.0 110.683 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.7 t0 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.416 179.891 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -81.69 131.82 35.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.862 0.363 . . . . 0.0 110.437 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -141.34 124.74 16.61 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.329 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.2 t -68.81 137.72 54.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.478 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.6 ' O ' ' CD2' ' A' ' 66' ' ' HIS . 34.9 t -62.01 -44.15 97.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.434 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.6 ' CD2' ' O ' ' A' ' 65' ' ' SER . 44.8 m80 -157.86 162.1 38.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.591 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.6 t -65.69 139.81 58.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.496 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.574 ' O ' ' N ' ' A' ' 70' ' ' GLY . 83.2 mtp180 -61.2 -45.14 95.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.889 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 78.7 mt 57.04 -74.18 0.02 OUTLIER 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.704 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 68' ' ' ARG . . . 107.17 20.98 8.3 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 44.08 34.82 1.03 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 110.723 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 28.4 pt -66.69 -22.61 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.502 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.501 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 97.4 mt-10 -78.1 -174.26 3.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.524 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 73' ' ' GLU . . . 70.5 -56.15 0.61 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.546 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -81.4 23.25 0.63 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.623 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.0 p -55.89 -36.58 67.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.548 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.0 tm-20 -122.17 112.95 18.82 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.223 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 80' ' ' GLU . 60.5 m 46.67 -106.01 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.343 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 68.0 -38.43 0.36 Allowed 'General case' 0 CA--C 1.528 0.115 0 O-C-N 123.495 0.497 . . . . 0.0 110.738 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.52 ' H ' ' C ' ' A' ' 78' ' ' SER . 16.5 mm-40 -64.81 -33.74 76.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.276 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -58.22 -30.79 66.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.342 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.13 -45.95 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.874 0.369 . . . . 0.0 110.187 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.12 -42.1 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.507 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -56.49 -44.57 80.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.478 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -64.67 -41.53 96.02 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 110.528 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 80.4 mt -60.14 -41.73 87.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.208 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.141 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 75.8 mtp85 -54.63 -45.74 73.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.431 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -63.69 -49.93 71.2 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.387 0.613 . . . . 0.0 110.232 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.1 -32.56 73.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.903 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -65.58 -36.33 83.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.264 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -63.56 -52.04 62.79 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.229 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.02 -26.37 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.415 0.626 . . . . 0.0 110.715 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.21 -38.56 10.95 Favored Glycine 0 N--CA 1.466 0.644 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.66 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.6 t70 -78.75 -44.07 24.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.415 0.15 . . . . 0.0 111.045 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 5.0 m -77.02 121.47 23.56 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.086 0.469 . . . . 0.0 110.809 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 94.0 mmm -140.38 19.45 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -63.23 -38.92 93.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.725 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -61.51 -40.41 94.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.651 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.9 m -82.34 -73.48 0.39 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 4.3 pt -102.46 147.21 33.67 Favored Pre-proline 0 N--CA 1.464 0.271 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.77 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.21 150.42 76.75 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 C-N-CA 122.152 1.901 . . . . 0.0 112.094 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -71.83 153.13 58.77 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.751 2.301 . . . . 0.0 112.003 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.534 ' O ' ' N ' ' A' ' 106' ' ' VAL . . . 39.13 -137.38 1.09 Allowed Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 105' ' ' LEU . 10.8 mp 56.94 -77.96 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.745 0.307 . . . . 0.0 110.728 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.534 ' N ' ' O ' ' A' ' 104' ' ' GLY . 9.9 p -55.51 -43.34 72.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.98 0.419 . . . . 0.0 110.525 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.505 ' N ' HG13 ' A' ' 106' ' ' VAL . 65.8 t30 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.633 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -60.34 -34.81 86.48 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 17.2 mt -61.55 -42.3 98.63 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.481 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.51 -39.16 70.14 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.371 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.2 mt -67.78 -38.19 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.848 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -59.12 -40.6 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.151 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.554 ' O ' HG22 ' A' ' 116' ' ' THR . 4.2 mm? -63.13 -42.56 99.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.923 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 67.7 ttt-85 -78.43 -42.1 31.04 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.038 0.447 . . . . 0.0 110.677 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.579 ' C ' ' H ' ' A' ' 117' ' ' SER . 97.8 m-20 -48.78 -31.78 7.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.833 -178.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.554 HG22 ' O ' ' A' ' 113' ' ' LEU . 1.4 t -59.78 3.71 0.05 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.585 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.579 ' H ' ' C ' ' A' ' 115' ' ' ASN . 9.4 p 54.76 46.04 25.42 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.95 0.405 . . . . 0.0 110.448 -178.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.429 ' CG ' ' N ' ' A' ' 119' ' ' SER . 13.8 ptm180 -58.55 -46.18 87.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.645 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.429 ' N ' ' CG ' ' A' ' 118' ' ' ARG . 67.0 m -166.98 153.73 8.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.566 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -83.86 72.61 10.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.202 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -58.52 -17.39 20.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -87.8 10.69 17.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.432 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.54 -43.96 96.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.494 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.515 ' C ' ' H ' ' A' ' 126' ' ' ASP . 90.6 m-20 -65.82 -39.47 90.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.236 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.533 ' NH1' ' OE2' ' A' ' 132' ' ' GLU . 0.0 OUTLIER -71.27 17.44 0.08 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.373 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.515 ' H ' ' C ' ' A' ' 124' ' ' ASN . 42.8 t0 -74.69 -78.58 0.1 Allowed 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.733 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 51.5 mt -66.75 -34.99 79.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.835 0.35 . . . . 0.0 111.019 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -36.12 63.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.797 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 72.4 m -61.23 -46.76 89.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.446 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.53 89.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.581 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.37 -42.88 99.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.638 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.533 ' OE2' ' NH1' ' A' ' 125' ' ' ARG . 93.3 mt-10 -62.61 -48.94 77.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.668 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -58.86 -43.14 90.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.425 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 46.2 tp -63.57 -46.92 83.68 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.325 -0.55 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.596 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.43 -37.75 76.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.294 0.569 . . . . 0.0 110.59 -178.001 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -55.84 -25.45 42.05 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.416 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -162.01 93.14 0.87 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.655 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.636 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 5.0 p90 -131.49 75.7 76.53 Favored Pre-proline 0 N--CA 1.47 0.574 0 CA-C-O 121.777 0.799 . . . . 0.0 110.654 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -79.92 47.3 2.48 Favored 'Trans proline' 0 C--N 1.299 -2.032 0 C-N-CA 122.242 1.961 . . . . 0.0 111.647 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 142' ' ' MET . 76.9 ttt180 -68.06 129.84 41.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.682 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' A' ' 143' ' ' GLU . 99.4 m-20 39.25 -97.0 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.737 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' MET . . . . . 0.417 ' N ' ' O ' ' A' ' 140' ' ' ARG . 38.1 ttm 60.8 -73.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.481 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 141' ' ' ASP . 82.9 tt0 -68.38 -33.9 75.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -61.74 -34.83 76.52 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -69.87 -38.91 76.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.575 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -68.32 -39.98 81.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.964 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 85.4 m -60.12 -43.01 95.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.312 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.1 tpp -60.27 -46.82 88.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.227 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.02 -46.5 71.05 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.5 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 67.9 t -62.26 -41.89 93.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.402 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 47.9 tp -58.28 -45.79 87.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.12 -39.78 93.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.976 0.417 . . . . 0.0 110.266 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 44.3 tp -60.39 -41.22 93.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.83 -44.43 96.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.116 0.484 . . . . 0.0 110.068 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.01 -45.4 92.52 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.213 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.07 -35.81 78.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.549 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -60.31 -47.45 85.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.489 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.23 -39.23 94.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.065 0.46 . . . . 0.0 110.428 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 78.0 t -68.35 -43.17 84.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.557 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.25 99.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.333 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 46.3 t -156.24 154.74 31.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 110.548 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -81.96 -35.8 28.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.611 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 m 64.95 84.38 0.18 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.224 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.97 147.61 62.4 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 122.725 2.283 . . . . 0.0 112.232 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 31.1 t -64.86 113.63 3.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.469 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 55.6 tp -174.09 -80.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.327 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 61.3 mt -62.69 -25.6 68.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.516 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -60.84 -43.93 97.64 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.372 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -70.01 -43.88 70.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.036 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.05 -46.73 95.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.603 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -65.01 -37.06 86.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.727 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -59.69 -49.42 77.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.302 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.3 m -59.58 -46.13 89.85 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.863 0.363 . . . . 0.0 110.371 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.0 m -53.22 -43.8 67.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.44 -43.17 97.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.772 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -66.34 -38.65 88.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.944 0.402 . . . . 0.0 110.842 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -60.09 -39.92 87.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.561 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.2 mt -61.93 -42.27 94.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.6 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.478 ' O ' ' O ' ' A' ' 180' ' ' GLN . 98.5 m-20 -52.05 -34.33 42.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.222 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 180' ' ' GLN . . . . . 0.478 ' O ' ' O ' ' A' ' 179' ' ' ASN . 87.1 mt-30 -38.73 -100.57 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.194 0.521 . . . . 0.0 111.103 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -130.32 -8.01 4.24 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.142 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.491 ' O ' HG23 ' A' ' 186' ' ' VAL . 10.9 mp -59.8 -36.09 76.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.448 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 183' ' ' ARG . . . . . 0.445 ' HE ' ' HA ' ' A' ' 179' ' ' ASN . 5.9 ptp180 -50.74 -45.03 58.59 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.128 -177.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.6 m -62.32 -50.41 71.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.14 0.495 . . . . 0.0 110.456 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -65.35 -36.94 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.729 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 182' ' ' LEU . 40.4 t -61.46 -46.29 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.493 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -60.61 -53.61 55.39 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.146 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 47.9 m -58.71 -40.19 82.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.872 0.368 . . . . 0.0 110.432 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 25.4 mt -62.79 -42.16 99.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.59 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 190' ' ' ALA . . . . . 0.46 ' O ' ' O ' ' A' ' 191' ' ' ARG . . . -168.57 156.81 8.28 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.065 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 191' ' ' ARG . . . . . 0.46 ' O ' ' O ' ' A' ' 190' ' ' ALA . 95.7 mtt-85 57.59 131.78 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 O-C-N 123.503 0.502 . . . . 0.0 110.766 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.414 ' OD1' ' O ' ' A' ' 192' ' ' ASN . 44.8 p30 -160.94 140.45 10.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.433 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . 72.88 27.86 68.06 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 75.2 mtm -63.59 -40.56 97.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.804 0.335 . . . . 0.0 110.476 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.4 t0 . . . . . 0 C--O 1.22 -0.447 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.638 179.996 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -62.84 -41.5 99.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.774 0.321 . . . . 0.0 110.531 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.719 ' HE ' ' NE ' ' A' ' 99' ' ' ARG . 84.1 mtp180 -76.33 142.05 41.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.443 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.9 m 54.01 87.89 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.478 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -132.73 41.24 3.19 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.465 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 44.28 -167.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.718 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.4 p -71.75 162.66 29.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.25 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 17.9 mmm180 -108.45 94.13 4.89 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.297 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.5 mt -113.54 134.15 54.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.178 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -168.45 -35.94 0.02 OUTLIER Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.441 HH21 HD11 ' A' ' 86' ' ' ILE . 88.0 mtm180 -89.85 37.95 0.9 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.882 0.373 . . . . 0.0 110.817 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 68.2 mt -65.76 -43.24 93.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.396 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 58.1 mp0 -66.61 -35.98 81.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.513 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -85.86 60.14 6.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.504 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 50.7 p-10 -142.37 14.59 2.01 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.421 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 77.7 p -61.58 -42.25 98.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.632 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -65.38 -41.83 93.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.437 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.0 t -151.75 143.86 23.91 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.141 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -120.82 -46.94 2.32 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.545 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.63 -41.59 88.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.748 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.37 -39.36 94.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.0 mm -61.36 -44.16 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.232 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.0 mt -61.9 -41.74 91.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.179 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -59.88 -40.39 88.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.76 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.422 ' HA ' ' HE ' ' A' ' 88' ' ' ARG . 59.9 t-20 -66.65 -52.46 44.75 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.807 0.337 . . . . 0.0 110.943 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.441 HD11 HH21 ' A' ' 71' ' ' ARG . 1.4 mp -58.9 -38.31 72.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.017 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.99 -51.75 68.71 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.226 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.422 ' HE ' ' HA ' ' A' ' 85' ' ' ASN . 87.9 mtm180 -54.32 -48.95 70.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.44 -179.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -66.94 -45.16 78.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.398 0.618 . . . . 0.0 110.245 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.3 tt -59.65 -40.66 88.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.273 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.89 -46.92 86.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.382 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.03 -52.18 65.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.27 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.5 t -74.51 -25.99 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.429 0.633 . . . . 0.0 110.719 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.534 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.33 -24.1 76.88 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.862 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.496 ' O ' ' CB ' ' A' ' 96' ' ' SER . 99.6 m-20 -72.58 -46.82 52.45 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.921 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.496 ' CB ' ' O ' ' A' ' 95' ' ' ASP . 1.8 m 158.23 -79.54 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.64 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.438 ' O ' ' O ' ' A' ' 96' ' ' SER . 24.7 mmm 57.87 121.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.453 -179.504 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 53.21 21.47 2.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.545 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.719 ' NE ' ' HE ' ' A' ' 63' ' ' ARG . 83.8 mtp180 -138.83 -32.49 0.68 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.481 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.433 ' O ' HG23 ' A' ' 101' ' ' ILE . 7.3 t -163.39 80.55 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.955 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.501 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 14.1 pt -155.12 49.98 0.48 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.412 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 82.1 Cg_exo -35.41 99.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 123.026 2.484 . . . . 0.0 111.835 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.45 ' O ' ' O ' ' A' ' 104' ' ' GLY . 52.4 Cg_exo -53.23 135.06 59.01 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.291 1.994 . . . . 0.0 112.326 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.507 ' O ' ' N ' ' A' ' 106' ' ' VAL . . . 44.28 -169.47 0.02 OUTLIER Glycine 0 C--N 1.335 0.49 0 N-CA-C 109.917 -1.273 . . . . 0.0 109.917 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.597 HD12 ' N ' ' A' ' 105' ' ' LEU . 9.1 mp 64.08 -45.98 0.28 Allowed 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.866 0.392 . . . . 0.0 110.708 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.507 ' N ' ' O ' ' A' ' 104' ' ' GLY . 9.1 p -54.86 -39.01 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.188 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.531 ' OD1' ' N ' ' A' ' 108' ' ' GLY . 45.0 p-10 -58.63 -29.73 66.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.341 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.531 ' N ' ' OD1' ' A' ' 107' ' ' ASN . . . -69.71 -50.38 30.9 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 109' ' ' LEU . 8.7 mp -63.0 -42.38 99.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.929 0.395 . . . . 0.0 110.434 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.94 -49.04 76.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.629 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 72.2 mt -71.01 -44.04 66.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.919 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -57.63 -41.2 80.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.12 -43.9 97.82 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 119.809 -0.756 . . . . 0.0 110.142 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 84.2 mtt85 -71.87 -28.71 63.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.047 0.451 . . . . 0.0 110.268 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -62.87 -38.09 89.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.738 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.9 t -89.61 10.28 23.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.3 p -91.76 -5.61 53.28 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.66 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 83.4 mtt85 -68.0 -19.8 64.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.612 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.6 m -73.34 -6.55 46.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.638 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -169.25 126.83 0.95 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.591 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -174.86 -52.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.579 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -67.3 -19.53 65.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.527 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.431 ' O ' ' N ' ' A' ' 125' ' ' ARG . 84.4 mtp180 -57.14 -111.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.75 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -67.68 69.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.687 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' A' ' 123' ' ' ARG . 59.0 ttm-85 -157.46 -29.56 0.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.394 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -48.92 -82.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.321 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.2 mt -51.24 -33.43 28.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -49.36 69.73 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.435 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.4 m -61.69 -43.15 99.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.99 78.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.429 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -59.49 -41.64 90.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.56 -50.19 72.31 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.163 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -55.33 -45.54 76.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.449 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.56 -47.82 82.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.019 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.548 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -57.39 -41.23 79.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.7 -177.678 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -56.03 -25.41 44.48 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.126 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -124.68 77.36 1.59 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.787 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.68 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 46.6 t80 -97.41 -30.9 0.25 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.01 178.284 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.68 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 77.8 Cg_exo -47.92 96.63 0.03 OUTLIER 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 122.099 1.866 . . . . 0.0 112.341 -178.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.442 ' O ' ' O ' ' A' ' 141' ' ' ASP . 90.9 mtm180 -137.68 -86.17 0.29 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.563 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.538 ' CG ' ' H ' ' A' ' 142' ' ' MET . 41.6 p-10 -55.71 -113.49 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.858 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' MET . . . . . 0.538 ' H ' ' CG ' ' A' ' 141' ' ' ASP . 18.3 tpp 61.39 -95.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.81 -37.25 86.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.842 0.353 . . . . 0.0 110.756 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -60.54 -38.17 83.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.09 0.471 . . . . 0.0 111.156 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -75.96 -34.54 59.83 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.621 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.554 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 18.8 m -62.1 -44.11 97.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.536 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 19.1 mtm -61.67 -44.03 97.74 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.5 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.8 mt -67.91 -49.57 61.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 78.2 t -62.56 -43.2 98.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.378 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 49.8 tp -58.98 -45.46 90.54 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.439 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.03 -42.53 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.043 0.449 . . . . 0.0 110.275 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 24.2 tp -59.16 -41.85 89.36 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.115 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.4 -44.32 97.35 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.545 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.26 -46.61 82.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.356 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.26 -43.98 80.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.102 0.477 . . . . 0.0 110.43 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.56 -38.7 91.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.128 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -60.52 -41.27 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.321 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 88.5 t -66.38 -45.11 90.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.559 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.15 -35.34 80.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.05 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 35.9 p -157.73 160.93 38.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.198 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.461 ' O ' ' O ' ' A' ' 163' ' ' THR . 55.2 m80 -128.39 50.05 2.12 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.369 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.461 ' O ' ' O ' ' A' ' 162' ' ' HIS . 14.4 p 56.95 147.84 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.0 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.433 ' O ' ' CB ' ' A' ' 165' ' ' SER . 56.8 Cg_endo -70.74 -91.01 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.64 0 C-N-CA 122.153 1.902 . . . . 0.0 111.75 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.6 m 164.68 -68.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.112 0.482 . . . . 0.0 110.348 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 16.9 tp -65.09 -41.52 94.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.939 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.581 HD22 ' N ' ' A' ' 167' ' ' LEU . 3.9 mm? -64.44 -25.5 68.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.806 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.09 -43.81 73.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.876 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -66.76 -46.93 73.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.028 0.442 . . . . 0.0 110.913 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.5 -44.27 94.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.421 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' PHE . . . . . 0.4 ' O ' HG23 ' A' ' 175' ' ' VAL . 81.6 t80 -61.49 -37.62 84.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.486 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.68 -49.71 76.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.411 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.2 m -59.13 -42.51 90.81 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.53 -42.47 87.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.224 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 171' ' ' PHE . 69.6 t -61.76 -37.99 79.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.471 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -61.0 -41.12 95.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.867 0.365 . . . . 0.0 110.359 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -62.26 -47.33 84.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.111 0.481 . . . . 0.0 110.491 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 67.5 mt -70.26 -34.59 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.827 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.407 ' O ' ' N ' ' A' ' 181' ' ' ASN . 52.5 m-20 -48.67 -34.18 11.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.556 -178.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -43.26 -24.83 0.1 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.947 0.404 . . . . 0.0 110.881 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 179' ' ' ASN . 56.1 t-20 -116.67 -48.91 2.66 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.011 -179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.52 -36.05 77.45 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.519 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -51.81 -30.84 24.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.224 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 75.3 m -59.32 -51.42 70.01 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.836 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -70.6 -43.77 68.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.067 0.461 . . . . 0.0 110.889 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 69.6 t -64.35 -43.9 97.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.572 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.57 -45.2 92.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.562 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 37.6 m -59.22 -31.95 69.51 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.351 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.569 HD13 ' O ' ' A' ' 189' ' ' LEU . 0.2 OUTLIER -61.99 -44.19 97.24 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.181 -179.035 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -147.07 140.46 25.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.438 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -65.21 -43.23 92.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.743 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -83.39 113.43 20.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.454 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -63.62 -41.46 99.09 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 111.076 -0.809 . . . . 0.0 111.076 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 66.6 mtt -114.46 140.89 48.35 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.914 0.388 . . . . 0.0 110.522 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.3 p-10 . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.555 -179.842 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -63.06 -40.22 97.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.685 0.279 . . . . 0.0 110.482 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -79.37 132.81 36.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.409 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 m -73.06 135.36 44.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.394 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.454 ' O ' ' O ' ' A' ' 66' ' ' HIS . 94.9 p -106.29 -2.16 22.63 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.436 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.454 ' O ' ' O ' ' A' ' 65' ' ' SER . 68.6 m80 57.9 127.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 39.8 m -58.72 -34.99 71.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.574 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 48.15 74.58 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.566 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 69' ' ' LEU . 10.8 mp -63.36 -43.33 98.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.442 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 43.83 -118.49 2.25 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 24.4 mmt85 -83.68 133.03 34.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.877 0.37 . . . . 0.0 110.167 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.457 HG23 ' O ' ' A' ' 72' ' ' ILE . 10.1 tp -128.92 129.75 68.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.52 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 74' ' ' ALA . 97.1 mt-10 40.95 41.84 1.35 Allowed 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.579 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.542 ' C ' ' H ' ' A' ' 76' ' ' SER . . . 56.82 117.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.349 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 46.0 p-10 -61.13 2.96 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.496 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.542 ' H ' ' C ' ' A' ' 74' ' ' ALA . 47.6 t -60.64 -45.55 93.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.746 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -96.02 -71.75 0.66 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.534 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.3 t -45.38 -91.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.471 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.581 ' O ' HG22 ' A' ' 82' ' ' ILE . 37.4 tt0 70.88 -49.04 0.67 Allowed 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.463 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -69.36 -33.78 73.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.932 0.396 . . . . 0.0 110.871 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 81' ' ' ASP . 60.0 t0 -47.66 -32.0 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.634 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.581 HG22 ' O ' ' A' ' 79' ' ' GLN . 15.2 tt -61.39 -43.81 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.428 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.484 ' N ' HG23 ' A' ' 82' ' ' ILE . 96.6 mt -65.01 -43.54 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.138 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -50.7 -53.68 29.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.192 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -61.09 -42.08 97.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.598 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.6 mt -60.32 -52.02 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.064 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.24 93.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.194 0.521 . . . . 0.0 110.294 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -54.96 -45.57 74.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.196 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -65.22 -39.55 92.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mt -66.68 -37.97 85.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.422 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.82 -47.74 79.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.173 0.511 . . . . 0.0 110.19 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -62.12 -52.23 64.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -65.5 -27.49 41.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.355 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -64.1 -32.95 85.9 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.41 -44.4 92.86 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.578 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.4 p -161.62 89.54 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.917 0.389 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.5 mtm -60.94 -49.75 76.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.27 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.615 ' C ' ' H ' ' A' ' 100' ' ' SER . 67.8 t0 -176.85 123.81 0.15 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.312 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.6 mtm180 -55.41 1.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.615 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.6 t -59.59 -42.86 93.52 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.601 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.461 ' C ' ' O ' ' A' ' 100' ' ' SER . 3.0 pt -28.95 94.64 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.512 0 O-C-N 123.636 0.585 . . . . 0.0 110.925 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.456 ' O ' ' O ' ' A' ' 103' ' ' PRO . 70.9 Cg_exo -45.92 108.45 0.15 Allowed 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.246 1.964 . . . . 0.0 112.074 -178.056 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.456 ' O ' ' O ' ' A' ' 102' ' ' PRO . 60.3 Cg_exo -49.56 -170.47 0.0 OUTLIER 'Trans proline' 0 N--CA 1.493 1.489 0 C-N-CA 122.258 1.972 . . . . 0.0 112.132 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 91.13 -60.57 3.03 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.699 -0.961 . . . . 0.0 110.699 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.688 HD12 ' N ' ' A' ' 105' ' ' LEU . 7.5 mp -64.44 -43.01 95.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.042 0.449 . . . . 0.0 110.283 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 90.9 t -50.47 -41.7 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.946 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -57.72 -48.31 79.96 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.284 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.49 -51.1 58.65 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.92 -41.2 99.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.005 0.431 . . . . 0.0 110.121 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.69 -39.96 78.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.066 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.55 -44.29 96.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.516 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -68.01 -48.22 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.567 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 tp -61.35 -23.06 65.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.627 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -74.13 -43.99 55.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.795 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -63.23 -41.55 99.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.922 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.5 t -97.24 35.08 1.65 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.348 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.515 ' C ' ' H ' ' A' ' 119' ' ' SER . 21.8 m -66.86 -14.62 62.92 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.38 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.8 ptt85 -71.25 16.95 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.71 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.515 ' H ' ' C ' ' A' ' 117' ' ' SER . 58.3 m 56.78 95.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -63.54 128.62 36.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.432 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -89.98 -3.27 58.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.302 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -78.44 45.59 0.58 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.665 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -103.92 -34.39 8.51 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.903 0.382 . . . . 0.0 110.569 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.44 ' C ' ' H ' ' A' ' 126' ' ' ASP . 28.8 t-20 -64.88 -37.64 88.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.659 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.464 ' O ' ' N ' ' A' ' 129' ' ' THR . 9.6 ptp180 -50.75 -12.09 0.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.796 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.44 ' H ' ' C ' ' A' ' 124' ' ' ASN . 93.7 m-20 -50.3 -49.12 54.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.807 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.552 ' N ' HD22 ' A' ' 127' ' ' LEU . 4.0 mm? -71.63 -43.45 66.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.041 0.448 . . . . 0.0 110.855 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.6 70.18 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.445 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.464 ' N ' ' O ' ' A' ' 125' ' ' ARG . 96.7 m -57.47 -51.49 69.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.356 -179.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.21 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.04 0.448 . . . . 0.0 110.604 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.68 -47.02 82.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.411 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -56.2 -41.84 76.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.284 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -58.24 -45.46 87.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.8 -47.21 75.86 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.231 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.37 -33.76 76.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.628 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -56.66 -31.71 64.67 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.114 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -134.23 61.66 1.67 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.76 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.481 ' O ' ' CD2' ' A' ' 138' ' ' TYR . 89.2 t80 -165.42 71.89 1.36 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.74 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.422 ' O ' ' O ' ' A' ' 140' ' ' ARG . 60.5 Cg_endo -80.13 -83.43 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.722 2.282 . . . . 0.0 112.127 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.422 ' O ' ' O ' ' A' ' 139' ' ' PRO . 77.9 mmt-85 59.94 126.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.68 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.549 ' O ' ' N ' ' A' ' 143' ' ' GLU . 99.6 m-20 -65.69 -34.14 77.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.799 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.8 mtm 61.24 -64.26 0.07 Allowed 'General case' 0 N--CA 1.463 0.196 0 O-C-N 123.803 0.69 . . . . 0.0 110.85 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.549 ' N ' ' O ' ' A' ' 141' ' ' ASP . 10.1 pt-20 -51.3 -46.35 62.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.424 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LYS . . . . . 0.467 ' N ' ' CG ' ' A' ' 143' ' ' GLU . 88.1 tttt -62.88 -48.56 78.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.258 0.551 . . . . 0.0 109.985 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.82 -46.8 77.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.865 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 33.7 mtpt -65.98 -39.47 90.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.783 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 76.8 m -59.94 -47.8 84.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.749 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 74.1 mtm -61.4 -42.12 98.22 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.533 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.54 -43.33 85.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.809 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 64.6 t -67.97 -50.51 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.391 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.87 -44.2 96.74 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.001 0.429 . . . . 0.0 110.773 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.51 -37.74 88.48 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.19 -40.65 96.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.508 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.7 -49.46 77.42 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.789 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 155' ' ' LEU . 4.1 mm? -65.32 -43.4 91.13 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.715 179.233 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.43 -42.9 82.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.343 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -67.52 -36.73 81.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.344 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.13 -41.97 97.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.551 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 75.5 t -63.62 -45.35 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.681 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -59.62 -51.15 71.06 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.119 -0.633 . . . . 0.0 110.01 -179.34 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 161' ' ' SER . . . . . 0.44 ' O ' ' C ' ' A' ' 162' ' ' HIS . 17.5 t 35.02 -120.55 0.11 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.296 0.373 . . . . 0.0 110.631 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.44 ' C ' ' O ' ' A' ' 161' ' ' SER . 78.9 m-70 31.75 78.78 0.03 OUTLIER 'General case' 0 C--N 1.341 0.217 0 O-C-N 123.216 0.322 . . . . 0.0 111.555 178.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.547 HG21 ' HE ' ' A' ' 168' ' ' ARG . 17.9 m -129.61 80.58 71.51 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.237 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.97 149.88 67.78 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.904 2.403 . . . . 0.0 111.959 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 13.6 p -57.09 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.763 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 21.8 tp 67.87 -51.45 0.52 Allowed 'General case' 0 C--O 1.233 0.212 0 O-C-N 123.897 0.748 . . . . 0.0 110.191 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 51.5 tp -60.08 -43.6 95.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.933 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.547 ' HE ' HG21 ' A' ' 163' ' ' THR . 99.8 mtt180 -66.59 -37.88 85.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.691 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.52 -47.0 88.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.72 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 80.8 t -68.37 -43.15 84.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.298 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -58.4 -46.68 85.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.691 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 31.2 m80 -65.03 -48.81 72.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.943 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.97 -45.92 89.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.4 m -53.35 -44.82 68.83 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.152 0.501 . . . . 0.0 110.214 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.73 -43.13 90.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.421 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -58.77 -39.71 81.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -60.05 -44.04 94.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.262 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 36.1 mm -64.04 -41.97 94.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.029 0.442 . . . . 0.0 110.537 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 180' ' ' GLN . 59.9 t-20 -49.89 -34.44 20.26 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.809 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 180' ' ' GLN . . . . . 0.461 ' O ' ' O ' ' A' ' 179' ' ' ASN . 88.2 mt-30 -36.41 -96.71 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.798 0.332 . . . . 0.0 111.248 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -127.21 -15.24 5.26 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.901 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.539 HD12 ' N ' ' A' ' 182' ' ' LEU . 9.7 mp -64.65 -39.37 93.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.518 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -53.03 -32.69 48.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.613 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' THR . . . . . 0.413 ' HA ' ' HE ' ' A' ' 187' ' ' ARG . 20.2 m -57.22 -47.67 80.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.962 0.411 . . . . 0.0 110.6 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -67.55 -35.58 79.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.531 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 88.2 t -64.77 -43.9 96.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.549 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 187' ' ' ARG . . . . . 0.413 ' HE ' ' HA ' ' A' ' 184' ' ' THR . 87.8 mtm180 -60.34 -48.99 79.38 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.552 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 67.0 m -61.43 -42.36 98.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.851 0.358 . . . . 0.0 110.637 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 4.9 tp -99.26 39.48 1.29 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.578 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.31 -37.81 88.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.618 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 91.7 mtm180 -76.02 137.3 40.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.579 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 39.8 p30 -156.74 168.89 26.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.629 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -65.86 -40.09 95.34 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 46.0 ttp -61.69 -42.64 99.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.735 0.302 . . . . 0.0 110.433 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 25.0 t0 . . . . . 0 C--O 1.219 -0.529 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.566 -179.915 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -90.7 5.66 47.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.787 0.327 . . . . 0.0 110.575 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -80.11 140.28 36.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.701 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.9 m -88.05 -3.96 58.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.319 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 58.6 m -58.45 -42.62 87.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.633 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -100.27 75.23 1.79 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.456 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 38.7 t -63.12 -43.79 97.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.512 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -88.82 138.43 31.42 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.705 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.7 mt -63.93 -41.88 97.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.465 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 145.39 -59.62 0.5 Allowed Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.428 ' O ' ' O ' ' A' ' 72' ' ' ILE . 43.4 ttm180 -66.53 -18.32 65.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.858 0.361 . . . . 0.0 110.373 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.567 ' C ' ' H ' ' A' ' 74' ' ' ALA . 7.9 mm -61.05 -127.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.197 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 67.83 -33.8 0.23 Allowed 'General case' 0 CA--C 1.529 0.164 0 O-C-N 123.482 0.489 . . . . 0.0 110.548 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.567 ' H ' ' C ' ' A' ' 72' ' ' ILE . . . -65.6 -36.57 84.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.613 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -87.96 11.52 15.64 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.416 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 98.8 p -58.46 -20.84 48.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.551 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -61.85 -72.75 0.11 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.606 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.1 t -62.61 -44.3 96.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.654 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -58.61 -8.39 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.567 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -62.23 -36.77 83.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.396 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -60.21 -48.29 82.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.432 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.3 mt -66.44 -43.68 90.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.447 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.31 -43.63 98.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.238 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 78.6 ttt-85 -56.09 -48.04 76.87 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -60.79 -42.74 98.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.038 0.447 . . . . 0.0 110.658 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 82.9 mt -60.52 -45.38 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.05 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.64 -39.04 93.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.119 0.485 . . . . 0.0 110.197 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -56.69 -48.62 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.906 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.24 -45.85 89.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.246 0.546 . . . . 0.0 110.49 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.522 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.1 mt -63.8 -39.41 94.18 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.462 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.479 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.39 -46.9 76.54 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.417 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.6 tp60 -64.53 -52.38 58.02 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.163 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.7 t -65.32 -25.96 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.392 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.16 -32.38 14.33 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.404 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.479 ' N ' ' O ' ' A' ' 91' ' ' ALA . 64.7 t0 -70.69 -46.85 62.39 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.999 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.525 ' C ' ' H ' ' A' ' 98' ' ' ASP . 57.4 m -51.34 -105.93 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.815 0.34 . . . . 0.0 110.991 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 mmt 55.38 4.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.213 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.525 ' H ' ' C ' ' A' ' 96' ' ' SER . 98.1 m-20 -76.45 -67.11 0.72 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.344 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -90.09 -30.39 17.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.632 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.9 m -87.81 94.4 9.75 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.261 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -153.55 157.32 32.74 Favored Pre-proline 0 CA--C 1.533 0.298 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.979 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -82.1 162.0 17.97 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 C-N-CA 122.426 2.084 . . . . 0.0 112.653 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.613 ' C ' ' H ' ' A' ' 105' ' ' LEU . 54.1 Cg_exo -40.31 129.5 2.37 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 C-N-CA 122.895 2.396 . . . . 0.0 112.27 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -59.68 9.79 0.04 OUTLIER Glycine 0 CA--C 1.528 0.905 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.618 HD22 ' N ' ' A' ' 105' ' ' LEU . 3.7 mm? -67.46 -39.32 85.31 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.946 0.403 . . . . 0.0 110.288 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.61 HG13 ' N ' ' A' ' 107' ' ' ASN . 14.5 p -58.96 -48.44 86.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.405 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.61 ' N ' HG13 ' A' ' 106' ' ' VAL . 36.3 t30 -57.46 -34.37 68.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.361 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.79 -39.66 95.27 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 51.3 tp -60.43 -42.05 95.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 110.695 -179.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.82 -48.8 80.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.149 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.06 -42.26 76.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.245 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -50.84 -37.54 43.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.79 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' A' ' 117' ' ' SER . 64.6 mt -62.33 -43.28 99.2 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.199 -0.6 . . . . 0.0 109.992 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -55.65 -41.95 74.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.0 110.03 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -63.2 -39.78 95.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.387 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.483 ' C ' ' H ' ' A' ' 118' ' ' ARG . 45.0 p -85.06 -10.51 56.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.755 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 113' ' ' LEU . 59.7 p -74.61 19.01 0.14 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.378 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.483 ' H ' ' C ' ' A' ' 116' ' ' THR . 16.7 ptm180 -60.64 -35.27 75.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.444 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 37.6 m -65.01 -21.87 66.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.877 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 26.8 tp10 73.42 -54.64 0.69 Allowed 'General case' 0 C--O 1.232 0.164 0 O-C-N 123.706 0.629 . . . . 0.0 110.382 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 56.2 25.96 9.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.938 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -97.67 2.01 49.29 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.47 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -64.94 -49.97 68.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.894 0.378 . . . . 0.0 110.501 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -69.37 -39.06 78.27 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.648 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.472 ' O ' ' HB3' ' A' ' 128' ' ' ALA . 71.5 ttt180 -59.87 -30.7 69.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.777 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 125' ' ' ARG . 33.8 t0 -37.12 -94.48 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.77 -178.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.892 HD22 ' N ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -49.23 -28.69 4.83 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.732 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.892 ' N ' HD22 ' A' ' 127' ' ' LEU . . . -56.58 -39.58 73.75 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.14 0.495 . . . . 0.0 109.971 -178.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 88.0 m -61.79 -42.37 98.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.697 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.15 79.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.227 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -58.93 -44.91 91.45 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.385 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -67.06 -45.96 75.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.067 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -64.97 -37.0 86.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.78 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.6 tp -59.28 -54.49 46.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.362 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.77 -38.5 90.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.719 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -56.24 -31.95 64.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.435 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -134.92 94.24 3.13 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 110.366 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.572 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 72.4 t80 -155.14 44.51 0.23 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.882 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 58.8 Cg_endo -71.14 -14.69 31.9 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.762 2.308 . . . . 0.0 112.116 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -83.55 -175.5 5.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.57 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.4 t0 66.95 54.56 0.77 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.976 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' MET . . . . . 0.459 ' CG ' ' N ' ' A' ' 143' ' ' GLU . 12.8 ptm -165.87 -43.44 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.384 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 142' ' ' MET . 81.4 tt0 -66.64 -42.87 86.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.021 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.59 -29.8 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.684 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.55 -50.31 63.58 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.605 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.443 ' O ' HG23 ' A' ' 150' ' ' VAL . 20.2 ptmt -72.85 -30.16 63.78 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.827 -0.545 . . . . 0.0 110.819 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 68.4 m -60.24 -46.22 90.52 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.314 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 66.4 mtt -64.91 -46.58 81.1 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.581 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.5 mp -66.09 -47.29 74.73 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.032 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 146' ' ' LYS . 57.0 t -62.51 -43.66 98.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.038 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.3 tp -53.12 -46.3 68.71 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.2 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.33 -35.98 82.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tp -59.25 -44.83 92.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.536 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.83 -44.41 96.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.048 0.451 . . . . 0.0 110.143 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.3 -43.74 90.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.055 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.69 -44.99 69.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.686 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.427 ' O ' ' O ' ' A' ' 161' ' ' SER . 25.9 tptp -61.99 -40.59 96.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.572 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -62.39 -45.47 93.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.37 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.75 -43.99 82.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.687 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.94 -37.44 87.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.179 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 157' ' ' LYS . 41.1 t -172.36 176.84 3.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.275 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -128.2 142.67 51.1 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.829 0.347 . . . . 0.0 110.124 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.531 ' CB ' HH21 ' A' ' 168' ' ' ARG . 1.1 p -84.89 153.41 60.44 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.586 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.22 -162.38 0.1 OUTLIER 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 122.592 2.195 . . . . 0.0 111.83 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 61.6 p -146.34 90.02 1.91 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.478 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 47.9 tp -174.15 -70.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.492 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 55.1 mt -64.5 -26.97 68.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.307 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.531 HH21 ' CB ' ' A' ' 163' ' ' THR . 63.1 ttm-85 -60.06 -45.59 92.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.24 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.79 -46.03 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.935 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 75.6 t -63.22 -45.3 98.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.438 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -61.12 -38.23 85.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.095 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -59.75 -46.83 87.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.591 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.7 m -61.24 -46.99 88.1 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.6 m -52.59 -43.71 65.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.446 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 72.1 t -62.69 -43.41 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.292 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 176' ' ' ASN . . . . . 0.444 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 54.7 t-20 -71.77 -32.56 67.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.292 0.568 . . . . 0.0 110.649 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -58.94 -43.34 91.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.553 -179.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.35 -42.61 96.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.583 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.441 ' HA ' HH12 ' A' ' 183' ' ' ARG . 93.9 m-20 -51.49 -34.18 34.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.647 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 180' ' ' GLN . . . . . 0.421 ' O ' ' O ' ' A' ' 179' ' ' ASN . 59.4 tt0 -36.66 -93.84 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.628 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -151.45 4.64 0.44 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.124 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 186' ' ' VAL . 10.9 mp -48.55 -36.52 15.6 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.595 0.236 . . . . 0.0 110.626 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 183' ' ' ARG . . . . . 0.441 HH12 ' HA ' ' A' ' 179' ' ' ASN . 90.1 mtm-85 -51.75 -49.71 62.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.342 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 96.7 m -66.78 -49.65 65.21 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.106 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -62.3 -43.89 97.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.704 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 182' ' ' LEU . 46.8 t -59.59 -42.97 89.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.005 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -56.2 -53.88 51.91 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.797 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 9.9 p -62.83 -41.47 99.35 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.591 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.504 HD22 ' N ' ' A' ' 189' ' ' LEU . 4.2 mm? -89.15 -172.2 3.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.345 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . 56.19 55.99 6.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.36 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -62.85 -44.13 96.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.455 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -82.28 157.08 23.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.549 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -170.37 172.14 43.9 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 50.1 ttp -135.2 146.71 48.95 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.901 0.381 . . . . 0.0 110.413 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 34.5 t70 . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.496 -179.947 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.2 m120 57.88 34.45 24.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.949 0.404 . . . . 0.0 110.479 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 63' ' ' ARG . 1.4 tpm_? 45.43 85.3 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.037 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 97.9 p -156.14 163.01 40.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.604 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 96.9 p -160.04 164.9 32.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.403 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -111.56 143.74 41.93 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.414 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 68.5 m -75.07 151.87 38.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.644 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 67.8 ttp85 -81.66 140.5 34.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.564 HD12 ' N ' ' A' ' 69' ' ' LEU . 10.5 mp -95.58 111.65 23.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.985 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -92.28 -100.8 1.39 Allowed Glycine 0 CA--C 1.521 0.421 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -83.28 124.94 31.08 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 70.5 mt -94.64 97.01 6.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.21 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 39.47 60.23 1.62 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.887 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.469 ' O ' ' N ' ' A' ' 76' ' ' SER . . . 50.66 -138.68 0.99 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.273 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 46.65 15.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.668 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 74' ' ' ALA . 90.1 p -110.59 8.55 22.88 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.472 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.54 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.1 mp0 -98.93 -1.11 40.8 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.581 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.9 t -156.58 46.8 0.44 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.704 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -172.85 -73.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.36 -35.55 81.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.187 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -61.61 -41.52 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.493 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.429 ' O ' HD13 ' A' ' 86' ' ' ILE . 22.1 mm -62.06 -49.06 85.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.104 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.6 -42.53 94.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.167 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -51.46 -54.59 25.34 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.882 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -53.89 -44.02 70.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.944 0.402 . . . . 0.0 110.912 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 82' ' ' ILE . 1.5 mp -63.4 -49.88 80.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 120.288 -0.565 . . . . 0.0 109.511 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.483 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -60.37 -37.69 81.53 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.948 -179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -58.56 -47.19 85.05 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.561 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -68.88 -46.98 67.0 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.223 0.535 . . . . 0.0 110.854 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.71 -35.47 78.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.771 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.483 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -64.1 -42.74 96.78 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -64.05 -52.72 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.509 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.3 p -73.67 -27.09 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.216 0.531 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -78.37 -35.8 32.36 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.74 -47.05 82.58 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.788 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.9 m -163.48 143.59 8.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.34 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 ttm -72.41 98.44 2.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.286 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.452 ' O ' ' CB ' ' A' ' 99' ' ' ARG . 66.4 t0 41.75 42.59 2.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.317 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.452 ' CB ' ' O ' ' A' ' 98' ' ' ASP . 7.9 tpt180 80.07 -74.18 0.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.307 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.418 ' C ' HD12 ' A' ' 101' ' ' ILE . 5.7 p 176.55 84.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.749 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.699 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 1.4 mp -94.06 -30.38 0.29 Allowed Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.548 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.699 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 37.4 Cg_exo -57.51 166.4 4.82 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 C-N-CA 122.15 1.9 . . . . 0.0 111.844 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.509 ' C ' ' H ' ' A' ' 105' ' ' LEU . 75.3 Cg_exo -47.3 163.64 0.15 Allowed 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.437 2.092 . . . . 0.0 112.266 178.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -60.45 1.26 0.72 Allowed Glycine 0 CA--C 1.527 0.813 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' A' ' 103' ' ' PRO . 59.6 mt -62.28 -38.89 91.08 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.766 0.317 . . . . 0.0 110.525 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 99.3 t -61.21 -45.1 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.215 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -62.7 -41.4 99.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.92 -21.94 11.2 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.7 mt -61.53 -40.05 93.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.77 0.319 . . . . 0.0 110.579 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.14 -44.79 44.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.679 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.545 HD22 ' N ' ' A' ' 111' ' ' LEU . 3.9 mm? -65.67 -34.73 78.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.928 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -69.03 -47.16 66.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.388 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.99 -42.92 97.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.225 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -63.03 -46.2 88.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.195 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -70.81 -40.63 72.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.2 m -92.86 18.3 9.21 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.4 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.9 p -62.2 -20.28 64.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.463 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -62.92 -30.61 71.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.674 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.4 m -63.88 -105.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -174.01 -57.81 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.491 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 64.36 40.88 6.17 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.461 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -111.01 10.67 22.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.059 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -59.67 -44.47 93.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.086 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -66.37 -41.64 89.18 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.103 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -80.26 -4.24 52.48 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.378 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -42.27 -67.89 0.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.0 -40.46 91.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 120.796 0.332 . . . . 0.0 111.149 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -38.72 66.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.494 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 55.8 m -72.91 -42.77 63.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.75 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.02 87.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.079 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.9 -47.12 86.4 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.83 0.348 . . . . 0.0 110.716 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -55.07 -41.12 71.09 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.18 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -67.92 -38.47 82.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.661 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.74 -54.46 46.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.595 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.495 ' N ' HD12 ' A' ' 135' ' ' LEU . 8.2 mp -65.32 -40.26 93.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.012 0.434 . . . . 0.0 110.614 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 18.1 mm100 -66.93 -33.22 75.1 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.341 179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.07 -50.89 71.94 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.039 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.55 ' CE2' ' O ' ' A' ' 139' ' ' PRO . 0.1 OUTLIER -109.37 150.56 41.28 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.763 -179.403 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.55 ' O ' ' CE2' ' A' ' 138' ' ' TYR . 55.9 Cg_endo -72.26 156.62 54.87 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.405 2.07 . . . . 0.0 111.584 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -94.26 8.13 42.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.412 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -63.07 129.59 41.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.238 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.9 mtt -116.73 3.81 13.02 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.336 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -63.61 -34.81 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.785 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -60.9 -38.09 84.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.006 0.431 . . . . 0.0 110.241 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -62.04 -45.55 93.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.424 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.489 ' O ' HG23 ' A' ' 150' ' ' VAL . 99.1 mttt -66.92 -32.94 74.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 19.3 m -58.92 -45.46 90.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.259 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.7 mtt -63.16 -45.98 89.32 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.658 -0.417 . . . . 0.0 109.954 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.95 -42.65 80.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 146' ' ' LYS . 42.9 t -62.71 -43.17 98.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.285 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.27 -47.49 85.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.429 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.99 87.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.181 0.515 . . . . 0.0 109.728 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 5.6 tp -59.08 -40.77 86.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.168 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 29.1 mt -61.22 -44.73 96.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.966 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.7 -46.45 82.32 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.181 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.18 96.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.15 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -63.38 -38.94 93.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.301 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -58.17 -42.32 85.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.717 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.5 t -65.59 -46.07 90.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.281 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -69.1 -32.89 72.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.047 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 11.3 t -31.39 94.7 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.124 0.488 . . . . 0.0 110.996 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.511 ' CG ' ' O ' ' A' ' 161' ' ' SER . 89.2 m-70 -159.83 41.91 0.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.151 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.544 ' N ' ' CD ' ' A' ' 164' ' ' PRO . 0.5 OUTLIER -128.25 48.12 3.26 Favored Pre-proline 0 N--CA 1.466 0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.351 179.507 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 163' ' ' THR . 36.4 Cg_endo -66.1 140.71 60.73 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.503 2.136 . . . . 0.0 111.738 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.4 m 162.03 -177.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.432 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.546 ' N ' HD22 ' A' ' 166' ' ' LEU . 3.8 mm? -77.55 -10.76 59.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.554 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.598 ' C ' HD12 ' A' ' 167' ' ' LEU . 1.6 pp -61.6 -27.52 68.71 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.466 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -62.09 -47.09 86.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' ASP . . . . . 0.4 ' OD1' ' O ' ' A' ' 169' ' ' ASP . 66.7 t0 -66.71 -38.71 87.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.54 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 84.8 t -61.95 -46.51 96.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.586 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -61.21 -41.3 96.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.837 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.95 -49.71 76.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.501 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 85.2 m -60.07 -42.47 94.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.547 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.2 m -56.31 -43.19 78.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.435 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.0 t -61.33 -43.13 96.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.542 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -67.65 -41.79 83.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.797 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' PHE . . . . . 0.467 ' O ' ' O ' ' A' ' 180' ' ' GLN . 4.7 m-85 -64.26 -36.15 83.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.541 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 2.5 mm -54.91 -35.68 35.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.483 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -55.25 -53.76 51.99 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.577 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' GLN . . . . . 0.467 ' O ' ' O ' ' A' ' 177' ' ' PHE . 99.1 mt-30 -100.9 138.31 38.13 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.392 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 71.1 50.47 0.31 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.322 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 53.9 tp -67.4 -41.02 85.64 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.739 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -56.73 -32.78 65.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.415 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 69.3 m -61.0 -49.07 78.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -68.91 -42.22 77.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.027 0.441 . . . . 0.0 110.316 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.98 -42.69 97.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.682 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -58.95 -44.73 91.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.298 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.3 t -61.23 -44.48 97.2 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.775 0.321 . . . . 0.0 110.518 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 50.8 tp -63.27 -43.58 97.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.55 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 190' ' ' ALA . . . . . 0.541 ' O ' ' N ' ' A' ' 192' ' ' ASN . . . -72.95 -70.46 0.35 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.481 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 41.19 -88.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.795 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.541 ' N ' ' O ' ' A' ' 190' ' ' ALA . 40.4 t30 -63.41 -41.23 98.71 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.434 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 193' ' ' GLY . . . . . 0.531 ' O ' ' N ' ' A' ' 195' ' ' ASP . . . 57.3 30.19 61.04 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 43.7 ttm 57.21 -78.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.761 0.315 . . . . 0.0 110.488 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 195' ' ' ASP . . . . . 0.531 ' N ' ' O ' ' A' ' 193' ' ' GLY . 54.9 p-10 . . . . . 0 C--O 1.219 -0.527 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.463 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -85.58 114.19 22.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.827 0.346 . . . . 0.0 110.265 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 73.7 ttp85 -126.55 127.94 46.08 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.087 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.2 m 40.03 72.03 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.896 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.6 t -61.56 -43.27 99.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.442 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.485 ' CG ' ' N ' ' A' ' 67' ' ' SER . 86.0 t60 -153.04 160.93 43.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.518 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.485 ' N ' ' CG ' ' A' ' 66' ' ' HIS . 29.2 p -157.14 165.23 36.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.739 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -68.87 138.67 54.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.441 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.533 HD23 ' C ' ' A' ' 69' ' ' LEU . 3.2 tt -145.02 96.55 2.87 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.445 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -103.1 -178.8 26.43 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 48.92 82.72 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.705 0.288 . . . . 0.0 110.621 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.716 HG23 ' O ' ' A' ' 72' ' ' ILE . 19.0 tt -137.72 76.89 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.593 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.512 ' N ' ' OE1' ' A' ' 73' ' ' GLU . 57.5 mp0 40.38 21.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.756 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.531 ' N ' ' O ' ' A' ' 72' ' ' ILE . . . -167.36 161.23 14.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.484 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 55.31 16.12 1.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.745 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 59.7 p -91.36 -4.59 55.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.175 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -54.16 -35.64 62.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.377 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.0 m -126.72 -160.99 1.03 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.347 -0.388 . . . . 0.0 109.956 179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? 70.92 -56.52 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -65.22 -33.82 76.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.0 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -58.48 -45.4 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.525 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.46 -43.77 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.408 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.7 mt -62.41 -43.36 98.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -53.46 -53.18 55.09 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -58.1 -42.37 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.699 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.54 -51.59 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.011 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -61.81 -38.2 87.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.338 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -55.96 -47.51 77.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.607 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -66.23 -45.17 81.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.507 . . . . 0.0 110.826 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.451 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.3 mt -68.44 -33.6 74.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.471 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.46 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -58.78 -46.48 87.45 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.132 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.32 -51.99 60.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.077 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.39 -26.16 38.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.17 -22.96 42.59 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -63.13 -43.85 97.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.703 0.287 . . . . 0.0 111.077 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.582 ' C ' ' H ' ' A' ' 98' ' ' ASP . 32.7 t -165.83 -75.88 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.581 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.9 tpt 66.67 -14.25 0.16 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.358 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.582 ' H ' ' C ' ' A' ' 96' ' ' SER . 95.1 m-20 -72.03 -19.45 61.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.219 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -68.89 -41.22 78.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.68 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 77.0 p -63.7 -42.96 97.9 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.731 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.469 ' O ' ' O ' ' A' ' 98' ' ' ASP . 38.9 mt -110.93 129.56 23.84 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.943 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.509 ' O ' ' N ' ' A' ' 104' ' ' GLY . 73.0 Cg_endo -74.04 161.32 41.29 Favored 'Trans proline' 0 N--CA 1.493 1.458 0 C-N-CA 122.383 2.055 . . . . 0.0 112.512 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.498 ' O ' ' N ' ' A' ' 105' ' ' LEU . 85.2 Cg_exo -39.2 -22.37 0.08 OUTLIER 'Trans proline' 0 C--N 1.311 -1.447 0 C-N-CA 122.826 2.35 . . . . 0.0 112.077 178.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.569 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . 44.3 17.86 0.09 OUTLIER Glycine 0 CA--C 1.521 0.455 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.498 ' N ' ' O ' ' A' ' 103' ' ' PRO . 10.9 mp 58.64 -4.25 0.07 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.539 0.209 . . . . 0.0 110.484 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.569 ' H ' ' C ' ' A' ' 104' ' ' GLY . 69.2 t -64.92 -45.79 93.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.947 0.403 . . . . 0.0 110.249 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -64.22 -32.19 73.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.999 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -61.6 -35.25 90.86 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.03 -38.29 88.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.539 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -56.97 -47.56 80.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.385 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 111' ' ' LEU . 5.1 tt -65.53 -46.24 80.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.586 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -50.86 -36.35 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.647 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.494 ' O ' ' N ' ' A' ' 117' ' ' SER . 80.4 mt -61.49 -42.98 99.61 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.234 -0.586 . . . . 0.0 109.663 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -56.5 -42.54 78.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 110.151 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.86 -37.84 88.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.305 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.524 ' C ' ' H ' ' A' ' 118' ' ' ARG . 46.1 p -88.6 -12.52 42.38 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.755 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.494 ' N ' ' O ' ' A' ' 113' ' ' LEU . 83.5 p -70.83 34.11 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.666 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.524 ' H ' ' C ' ' A' ' 116' ' ' THR . 35.7 mmt180 -64.01 -35.68 81.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.211 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.509 ' C ' ' H ' ' A' ' 121' ' ' GLU . 52.8 p -67.33 8.86 0.27 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.683 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.52 ' H ' ' C ' ' A' ' 118' ' ' ARG . 55.9 mm-40 68.11 -42.81 0.47 Allowed 'General case' 0 C--O 1.231 0.094 0 O-C-N 123.58 0.55 . . . . 0.0 110.441 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.509 ' H ' ' C ' ' A' ' 119' ' ' SER . 95.7 mt-10 56.83 2.63 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.385 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.53 ' OD1' ' NH2' ' A' ' 125' ' ' ARG . 16.4 m-20 -127.87 -2.54 5.91 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.306 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -62.52 -41.45 98.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.619 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.552 ' C ' ' H ' ' A' ' 126' ' ' ASP . 86.5 m-20 -66.3 -66.35 0.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.964 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.53 ' NH2' ' OD1' ' A' ' 122' ' ' ASP . 15.6 ptt180 -62.92 7.8 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.845 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.552 ' H ' ' C ' ' A' ' 124' ' ' ASN . 65.7 t0 -62.45 -38.83 91.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.706 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.586 ' N ' HD22 ' A' ' 127' ' ' LEU . 3.6 mm? -71.49 -42.96 67.42 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.141 0.496 . . . . 0.0 111.16 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.85 -28.73 69.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.567 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 125' ' ' ARG . 6.0 m -60.42 -49.85 75.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.154 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.14 -45.65 90.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.29 -41.99 96.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.644 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -55.33 -45.02 76.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.138 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -61.91 -47.05 86.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.726 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.4 tp -64.5 -49.12 72.58 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.456 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.599 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.08 -31.95 67.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.231 0.539 . . . . 0.0 110.214 -178.125 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.91 -25.76 44.42 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.681 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -108.68 -114.15 0.29 Allowed 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 29.3 t80 64.23 59.32 1.64 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.95 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.451 ' O ' ' O ' ' A' ' 140' ' ' ARG . 60.9 Cg_endo -75.48 -10.28 20.4 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.538 2.158 . . . . 0.0 110.845 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 139' ' ' PRO . 92.9 mtt180 -51.38 -171.87 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.523 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 56.57 48.56 16.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.667 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 64.4 mtt -144.6 -63.15 0.36 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.748 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -65.23 -44.6 87.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.009 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.13 -34.15 77.72 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.148 -179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -64.92 -43.32 93.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.069 0.462 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 150' ' ' VAL . 51.7 mtmt -66.46 -36.18 82.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.582 179.083 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 58.5 m -58.56 -43.77 89.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.262 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mmm -61.36 -46.56 89.72 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.356 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.0 -43.82 81.91 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.122 0.487 . . . . 0.0 110.673 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 146' ' ' LYS . 47.1 t -60.68 -45.28 97.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.563 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 36.3 mt -58.13 -45.66 86.95 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.434 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.85 -40.43 91.72 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.389 -0.525 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.23 -45.28 84.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.267 -178.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.54 -44.04 97.77 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.746 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.598 ' O ' HD23 ' A' ' 155' ' ' LEU . 4.0 tt -65.08 -51.66 60.14 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.031 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.68 -41.87 98.1 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.758 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -63.79 -36.73 84.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.311 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -62.32 -39.36 92.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.385 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.9 t -67.89 -49.47 68.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.668 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.483 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -70.89 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.325 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 161' ' ' SER . . . . . 0.513 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 38.5 t -24.7 90.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.812 0.695 . . . . 0.0 111.186 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.513 ' CG ' ' O ' ' A' ' 161' ' ' SER . 70.3 m-70 -160.74 38.25 0.16 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.423 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 p -101.26 150.41 37.13 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.631 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.63 166.08 30.54 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 122.807 2.338 . . . . 0.0 111.782 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 41.3 t -108.58 100.87 10.07 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.645 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 58.2 tp -172.74 -80.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.535 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 62.0 mt -62.4 -25.93 68.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.371 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -60.59 -45.45 93.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.099 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -65.48 -42.02 92.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.583 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 83.6 t -62.3 -44.64 99.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.325 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.17 -40.61 81.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -60.69 -44.48 96.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.418 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 11.9 m -64.89 -40.24 94.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.795 0.331 . . . . 0.0 110.618 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.7 m -58.35 -50.74 72.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.984 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.9 -33.36 61.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.584 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -71.34 -39.7 71.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.062 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -61.84 -39.72 92.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.721 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 93.7 mt -59.92 -41.56 86.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.563 -179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 180' ' ' GLN . 95.7 m-20 -49.57 -34.13 16.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.006 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 180' ' ' GLN . . . . . 0.432 ' O ' ' O ' ' A' ' 179' ' ' ASN . 99.0 mm-40 -38.01 -95.96 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.029 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -128.73 -16.76 4.16 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.984 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 182' ' ' LEU . 9.8 mp -62.55 -36.41 82.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.796 0.332 . . . . 0.0 110.191 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -51.79 -43.72 63.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.471 -177.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.1 m -61.86 -52.25 64.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.81 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -66.65 -41.65 87.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.004 0.431 . . . . 0.0 110.965 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 182' ' ' LEU . 74.6 t -64.19 -43.44 97.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.554 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -57.68 -52.52 65.11 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.449 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 57.1 m -58.48 -49.04 78.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.701 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.482 ' C ' ' H ' ' A' ' 191' ' ' ARG . 49.2 tp -176.57 149.61 0.8 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.425 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -70.21 10.61 0.42 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.358 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 191' ' ' ARG . . . . . 0.482 ' H ' ' C ' ' A' ' 189' ' ' LEU . 78.4 ttt-85 -66.74 136.25 55.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.35 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -88.44 160.01 17.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.272 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -65.85 131.05 33.87 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 194' ' ' MET . . . . . 0.443 ' C ' ' SD ' ' A' ' 194' ' ' MET . 1.3 tmt? -148.98 120.89 8.18 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.735 0.302 . . . . 0.0 110.444 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.517 179.885 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 22.2 p30 -154.81 170.88 20.6 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.752 0.311 . . . . 0.0 110.576 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 49.29 75.09 0.16 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.596 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.9 m -69.92 144.94 52.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.528 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.0 p -158.2 162.13 37.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.583 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 44.25 88.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.654 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.6 p -74.45 162.77 28.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.616 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -74.18 144.73 44.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.72 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 32.4 tp -154.67 73.28 0.89 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.243 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.06 -40.97 93.15 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -87.02 133.44 33.58 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.794 0.33 . . . . 0.0 110.477 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.432 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 8.9 mt -143.04 -64.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.452 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -68.01 -36.41 79.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.635 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.2 -48.95 77.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.625 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.501 ' N ' ' OD1' ' A' ' 75' ' ' ASP . 17.8 p-10 -91.49 -112.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.537 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.44 ' O ' ' OG ' ' A' ' 76' ' ' SER . 10.9 t 54.12 22.68 3.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.632 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.449 ' C ' ' H ' ' A' ' 79' ' ' GLN . 79.1 tt0 -160.09 89.01 0.84 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.363 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.6 t 70.43 -43.25 0.54 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.933 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.449 ' H ' ' C ' ' A' ' 77' ' ' GLU . 82.7 mt-30 -63.58 -37.2 86.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.372 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -60.31 -36.77 78.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.33 -49.71 75.9 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.875 0.369 . . . . 0.0 110.661 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 94.3 mt -64.54 -43.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.284 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.03 -43.27 97.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.787 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttm-85 -53.43 -53.69 47.63 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -58.0 -44.0 86.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.031 0.443 . . . . 0.0 110.632 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 93.1 mt -61.43 -50.47 80.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.563 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.09 -39.92 83.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.515 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 62.1 ttt85 -54.4 -45.71 72.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.034 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -63.31 -44.62 94.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.484 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.2 mt -64.66 -39.25 93.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.558 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.85 -44.56 74.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.117 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -64.51 -51.77 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.31 179.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -26.29 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.665 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.11 -19.79 56.64 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -62.74 -46.88 86.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.775 0.321 . . . . 0.0 110.536 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.0 m -77.41 -69.87 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.865 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.4 ttp -76.93 -177.66 4.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.13 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 55.75 36.37 27.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.764 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -105.81 2.04 27.44 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.643 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m -154.81 -1.95 0.16 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.933 0.397 . . . . 0.0 110.883 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.669 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 1.4 mp -94.73 -30.19 0.28 Allowed Pre-proline 0 CA--C 1.538 0.511 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.138 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.669 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 87.9 Cg_exo -44.97 105.0 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 121.788 1.659 . . . . 0.0 112.333 -178.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.509 ' O ' ' O ' ' A' ' 102' ' ' PRO . 54.1 Cg_exo -52.54 -135.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.503 2.033 0 C-N-CA 122.433 2.088 . . . . 0.0 112.357 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.11 16.82 77.99 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.3 pp -148.49 -40.12 0.16 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.815 0.34 . . . . 0.0 110.579 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.515 HG23 ' N ' ' A' ' 107' ' ' ASN . 35.7 m -64.17 -43.75 97.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.271 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.515 ' N ' HG23 ' A' ' 106' ' ' VAL . 27.2 t-20 -64.62 -50.56 66.68 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.966 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -63.08 -31.44 80.72 Favored Glycine 0 CA--C 1.522 0.507 0 N-CA-C 110.739 -0.945 . . . . 0.0 110.739 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.6 -48.45 81.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -47.74 84.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.443 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.55 HD13 ' O ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -64.22 -45.75 86.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.123 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLN . . . . . 0.44 ' O ' ' OD1' ' A' ' 115' ' ' ASN . 58.1 tt0 -61.73 -35.31 77.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.031 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.2 tp -64.23 -33.42 75.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.392 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ARG . . . . . 0.453 ' C ' ' N ' ' A' ' 116' ' ' THR . 61.3 ttp180 -60.0 -40.76 90.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.741 -179.333 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 116' ' ' THR . 33.1 p-10 -48.82 -13.96 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.668 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.454 ' N ' ' OD1' ' A' ' 115' ' ' ASN . 99.5 m -61.42 -46.5 89.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.692 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.524 ' O ' ' N ' ' A' ' 119' ' ' SER . 29.0 p -79.27 -52.87 7.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.632 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' A' ' 117' ' ' SER . 30.9 ptt180 33.71 31.05 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.224 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.524 ' N ' ' O ' ' A' ' 117' ' ' SER . 47.1 m -122.04 -11.43 8.48 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.66 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -89.39 -10.89 44.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.911 0.386 . . . . 0.0 110.515 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -68.72 -38.75 80.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.08 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 36.3 p30 -87.42 0.08 56.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.627 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -68.11 -42.98 79.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.007 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.533 ' C ' ' H ' ' A' ' 126' ' ' ASP . 97.7 m-20 -136.01 -33.23 0.85 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.648 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.59 15.95 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.313 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.533 ' H ' ' C ' ' A' ' 124' ' ' ASN . 39.2 t70 -80.83 -76.63 0.23 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.796 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 pp -59.75 -31.66 69.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.702 0.286 . . . . 0.0 110.837 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.14 -40.35 70.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.18 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 27.0 m -60.79 -50.7 72.41 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.102 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.5 73.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.245 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.64 -46.23 89.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.137 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.28 -47.93 59.01 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.625 -0.43 . . . . 0.0 109.991 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -59.82 -43.55 94.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.671 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 5.7 tt -64.14 -41.27 97.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.978 0.418 . . . . 0.0 110.703 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -27.69 46.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -55.4 -25.24 34.58 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.023 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -115.72 -107.22 0.38 Allowed 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.524 ' OH ' ' NH1' ' A' ' 140' ' ' ARG . 76.3 t80 57.37 64.65 4.1 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.9 0.381 . . . . 0.0 110.673 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.429 ' O ' ' O ' ' A' ' 140' ' ' ARG . 62.9 Cg_endo -77.47 -50.14 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.378 2.052 . . . . 0.0 111.75 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.524 ' NH1' ' OH ' ' A' ' 138' ' ' TYR . 56.2 ttp180 55.59 162.42 0.02 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.605 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.592 ' O ' ' N ' ' A' ' 144' ' ' LYS . 45.9 t0 -47.72 -45.17 28.44 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' MET . . . . . 0.45 ' C ' ' O ' ' A' ' 141' ' ' ASP . 39.0 ttm -28.09 -48.34 0.05 Allowed 'General case' 0 N--CA 1.473 0.707 0 O-C-N 123.408 0.442 . . . . 0.0 111.143 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -66.06 -48.09 72.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.282 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LYS . . . . . 0.592 ' N ' ' O ' ' A' ' 141' ' ' ASP . 39.3 ttmt -63.69 -36.46 83.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.143 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -71.32 -45.95 61.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.882 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -57.78 -49.45 76.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.419 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 3.5 m -64.41 -50.24 68.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.007 0.432 . . . . 0.0 110.514 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 21.8 ttp -62.13 -34.88 77.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.65 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 46.1 tp -59.67 -48.25 82.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.188 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.52 -43.96 95.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.568 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 56.7 tp -61.38 -45.88 92.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.379 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.92 73.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.405 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.4 tp -66.47 -39.39 88.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.43 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 37.6 mt -61.51 -45.83 92.55 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.466 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.421 HD22 ' N ' ' A' ' 155' ' ' LEU . 4.1 mm? -65.95 -39.81 90.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.681 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.22 -42.19 66.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.526 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -66.72 -41.78 87.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.689 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -61.49 -45.32 94.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.575 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 69.5 t -63.42 -44.89 99.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.38 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.48 -39.23 92.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.832 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 47.0 m -164.89 164.37 20.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -122.04 134.61 54.79 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' THR . . . . . 0.475 ' OG1' ' NH2' ' A' ' 168' ' ' ARG . 0.5 OUTLIER -90.24 157.3 45.34 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 120.641 0.257 . . . . 0.0 110.541 -179.371 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 163' ' ' THR . 76.3 Cg_exo -42.19 170.05 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.411 2.074 . . . . 0.0 111.959 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 79.9 p -119.82 15.91 12.64 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.623 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 54.7 tp -127.2 -45.12 1.55 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.712 0.291 . . . . 0.0 110.645 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.503 HD12 ' N ' ' A' ' 167' ' ' LEU . 10.8 mp -59.88 -39.81 86.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.05 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.475 ' NH2' ' OG1' ' A' ' 163' ' ' THR . 9.7 ptp180 -71.17 -34.44 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.608 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' ASP . . . . . 0.493 ' O ' HG23 ' A' ' 173' ' ' THR . 91.3 m-20 -62.31 -46.89 86.72 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.96 -179.13 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.449 ' O ' ' OG1' ' A' ' 173' ' ' THR . 7.5 p -69.97 -33.28 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.133 0.492 . . . . 0.0 110.119 179.152 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -59.16 -46.28 88.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.115 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -65.32 -42.24 93.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' THR . . . . . 0.493 HG23 ' O ' ' A' ' 169' ' ' ASP . 51.9 p -58.21 -46.09 86.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.348 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.8 m -59.63 -44.63 93.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.917 0.389 . . . . 0.0 110.341 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.79 -44.28 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.481 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -56.93 -40.96 77.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.334 -179.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -62.31 -45.26 94.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.33 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.83 -43.51 98.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.095 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -49.54 -34.86 18.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.31 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -93.18 141.63 28.2 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 59.13 41.68 20.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.507 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER -61.87 -44.46 96.77 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.269 -179.245 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -59.11 -37.58 77.52 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.209 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -60.55 -46.99 88.15 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.392 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -64.0 -35.59 81.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 190' ' ' ALA . 62.0 t -59.82 -45.62 94.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.213 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.45 -49.9 73.58 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.691 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.5 t -59.96 -41.68 92.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.442 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.51 HD22 ' N ' ' A' ' 189' ' ' LEU . 3.8 mm? -93.21 4.23 54.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.687 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 190' ' ' ALA . . . . . 0.506 ' O ' ' N ' ' A' ' 192' ' ' ASN . . . -39.58 -70.62 0.1 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.71 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 40.5 -92.35 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.728 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.506 ' N ' ' O ' ' A' ' 190' ' ' ALA . 75.2 m-20 -63.04 -40.98 99.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.36 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 193' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' A' ' 190' ' ' ALA . . . 84.22 100.63 0.6 Allowed Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 28.3 ttt -63.48 -41.51 98.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.766 0.317 . . . . 0.0 110.52 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 53.9 p-10 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.98 -1.009 . . . . 0.0 110.443 179.894 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 63.4 t-20 -85.92 108.47 18.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.814 0.34 . . . . 0.0 110.394 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -132.77 143.33 49.51 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.315 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 88.7 p -159.75 163.49 34.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.309 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.4 m -132.15 163.03 29.42 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.286 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -143.78 151.81 40.44 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.279 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.509 ' OG ' ' N ' ' A' ' 68' ' ' ARG . 27.1 t -174.71 -121.81 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.32 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.509 ' N ' ' OG ' ' A' ' 67' ' ' SER . 83.4 mtp180 55.34 -168.5 0.09 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.613 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.419 ' O ' ' O ' ' A' ' 68' ' ' ARG . 46.1 mt 59.24 149.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.291 179.724 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.512 ' C ' ' H ' ' A' ' 72' ' ' ILE . . . -53.57 170.1 0.96 Allowed Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.413 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 83.9 mtp180 -72.26 30.53 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.664 0.269 . . . . 0.0 110.848 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.512 ' H ' ' C ' ' A' ' 70' ' ' GLY . 20.8 tt -65.91 -41.18 89.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.748 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.474 ' N ' HG23 ' A' ' 72' ' ' ILE . 17.1 pt-20 -77.76 -8.11 57.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.535 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.416 ' O ' ' O ' ' A' ' 75' ' ' ASP . . . -65.13 -36.88 85.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.426 179.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.416 ' O ' ' O ' ' A' ' 74' ' ' ALA . 70.3 m-20 -59.21 -149.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.361 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.9 t 57.06 71.92 0.54 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.833 0.349 . . . . 0.0 110.66 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -173.04 -75.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.48 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.2 m -59.93 -40.7 89.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.392 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.414 HE22 HD11 ' A' ' 83' ' ' ILE . 1.9 tm0? 72.08 -64.61 0.38 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.311 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -65.3 -47.0 78.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.574 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -65.88 -33.96 77.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.353 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.68 -43.37 98.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.857 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.414 HD11 HE22 ' A' ' 79' ' ' GLN . 94.2 mt -63.44 -43.84 98.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.201 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.62 -55.49 23.2 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -53.2 -46.25 68.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.3 mm -62.15 -45.58 98.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 179.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -50.88 -35.08 31.02 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.826 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.8 mmt-85 -66.15 -50.01 65.44 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.815 0.34 . . . . 0.0 110.091 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -69.44 -50.42 45.8 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.109 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.573 ' O ' HD23 ' A' ' 90' ' ' LEU . 1.3 tt -53.88 -41.68 67.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.004 0.431 . . . . 0.0 109.853 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.95 -48.51 81.51 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.922 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -64.47 -51.94 60.51 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.412 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.418 HG12 ' HA ' ' A' ' 90' ' ' LEU . 3.1 p -68.62 -31.84 52.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 109.894 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -60.23 -34.25 83.64 Favored Glycine 0 CA--C 1.519 0.292 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.41 -47.56 84.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.129 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.3 m -114.01 111.78 22.21 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.132 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 79.7 mtp -85.38 -102.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 43.9 t0 50.99 18.99 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.601 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -140.58 -53.46 0.5 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.2 p -87.63 0.33 55.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.25 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.1 pt -39.72 148.56 0.3 Allowed Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.781 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -37.16 155.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.49 1.269 0 C-N-CA 122.297 1.998 . . . . 0.0 112.358 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.55 -161.6 0.08 OUTLIER 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 122.923 2.416 . . . . 0.0 111.659 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.602 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . 76.78 -169.29 54.95 Favored Glycine 0 CA--C 1.518 0.269 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.708 HD12 ' N ' ' A' ' 105' ' ' LEU . 6.4 mp 55.19 -0.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.751 0.31 . . . . 0.0 110.735 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 107' ' ' ASN . 33.7 m -59.3 -50.4 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.913 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.605 ' N ' HG23 ' A' ' 106' ' ' VAL . 20.6 t-20 -57.36 -46.65 83.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.228 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.5 -42.57 95.67 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.083 -1.207 . . . . 0.0 110.083 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 tp -59.42 -40.84 88.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.78 -37.44 87.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.6 tp -61.74 -48.75 79.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.866 0.365 . . . . 0.0 111.27 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLN . . . . . 0.555 ' O ' ' N ' ' A' ' 116' ' ' THR . 3.9 pt20 -71.92 -45.17 62.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.033 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.99 -25.79 65.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.3 -179.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -79.33 -49.2 12.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.54 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.51 ' C ' ' H ' ' A' ' 117' ' ' SER . 98.3 m-20 -89.35 -56.71 3.15 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.053 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.555 ' N ' ' O ' ' A' ' 112' ' ' GLN . 1.7 m -61.75 0.69 0.32 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.031 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.569 ' C ' ' H ' ' A' ' 119' ' ' SER . 4.7 p -48.06 177.13 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.218 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 71.77 -31.27 0.22 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.569 ' H ' ' C ' ' A' ' 117' ' ' SER . 43.1 m -54.68 -33.05 60.25 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.83 -178.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 119' ' ' SER . 72.1 tt0 -41.12 164.74 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.06 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 64.4 29.52 13.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.455 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.409 ' OD2' ' O ' ' A' ' 119' ' ' SER . 97.1 m-20 -127.09 3.23 6.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.341 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 66.8 mmt-85 -64.83 -45.87 84.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.656 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -67.12 -41.3 86.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.629 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.577 ' HG2' ' HB3' ' A' ' 128' ' ' ALA . 8.9 ttm180 -80.73 9.39 6.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.21 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -59.09 -49.26 78.57 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.03 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.31 -41.26 70.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.124 0.488 . . . . 0.0 111.175 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.577 ' HB3' ' HG2' ' A' ' 125' ' ' ARG . . . -62.77 -28.58 70.08 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.791 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 125' ' ' ARG . 96.6 m -59.67 -52.68 64.47 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.099 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.16 -47.34 74.33 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.817 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 30.5 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.379 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -53.6 -39.04 64.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.919 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -64.17 -36.55 84.41 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.562 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 134' ' ' LEU . 0.2 OUTLIER -61.64 -48.94 78.6 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.545 -178.757 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.472 HD22 ' N ' ' A' ' 135' ' ' LEU . 4.2 mm? -61.3 -29.76 70.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.435 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 -57.51 -37.63 73.32 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.279 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -106.87 64.02 0.64 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.406 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.418 ' OH ' ' SD ' ' A' ' 142' ' ' MET . 6.2 t80 -166.89 92.3 0.74 Allowed Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.339 179.587 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.13 145.25 54.68 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.343 2.029 . . . . 0.0 112.11 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 58.1 -169.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.363 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.433 ' O ' ' CB ' ' A' ' 142' ' ' MET . 66.4 t0 -114.27 -31.46 6.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.532 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' MET . . . . . 0.433 ' CB ' ' O ' ' A' ' 141' ' ' ASP . 2.5 ttt 77.99 -34.17 0.18 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.559 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.423 ' H ' ' C ' ' A' ' 141' ' ' ASP . 81.3 tt0 -65.36 -35.43 80.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.599 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -63.37 -40.99 98.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.776 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.475 ' OE1' ' N ' ' A' ' 145' ' ' GLU . 57.9 mp0 -67.7 -52.45 37.59 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.794 -0.762 . . . . 0.0 109.51 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -53.15 -38.76 63.02 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.555 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 16.8 m -61.85 -43.31 99.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.511 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 50.6 mtt -62.66 -39.42 93.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.747 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.437 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.6 t -61.69 -42.3 93.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.281 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.41 -44.99 92.76 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.203 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.08 -31.5 72.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.818 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.74 -39.96 69.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.43 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 16.3 mt -60.87 -42.14 97.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.039 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.505 ' O ' HD13 ' A' ' 155' ' ' LEU . 0.2 OUTLIER -62.35 -49.79 74.15 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.667 -179.657 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.8 -36.04 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.621 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -62.27 -45.66 92.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.583 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.13 -41.39 98.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.768 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.7 t -61.51 -46.65 96.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.485 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.41 -48.81 76.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.971 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 37.2 t -162.94 158.98 23.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.456 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -134.21 133.14 40.55 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.933 0.397 . . . . 0.0 110.429 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.12 155.0 80.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.322 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.51 -19.4 54.8 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.627 2.218 . . . . 0.0 111.867 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' SER . . . . . 0.518 ' O ' ' N ' ' A' ' 167' ' ' LEU . 7.7 t 52.13 -148.07 0.42 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.256 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 45.3 mt 59.5 -74.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.755 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 165' ' ' SER . 47.5 mt -62.6 -41.07 98.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.313 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -62.55 -43.51 98.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' ASP . . . . . 0.442 ' O ' HG23 ' A' ' 173' ' ' THR . 98.8 m-20 -63.25 -44.14 96.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.651 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.444 ' O ' ' OG1' ' A' ' 173' ' ' THR . 71.0 t -63.41 -47.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.881 0.372 . . . . 0.0 110.398 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.07 -47.0 86.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.439 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -64.26 -40.34 95.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' THR . . . . . 0.444 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 8.9 p -62.94 -43.76 97.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.607 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.7 m -61.97 -50.46 72.02 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.473 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.6 t -62.08 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.213 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -62.18 -39.74 93.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -58.81 -47.08 86.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.583 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.97 -42.82 95.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.431 . . . . 0.0 110.634 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.416 ' C ' ' N ' ' A' ' 181' ' ' ASN . 11.6 m120 -49.87 -34.49 20.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.696 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -46.91 -19.48 0.1 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.91 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 181' ' ' ASN . . . . . 0.416 ' N ' ' C ' ' A' ' 179' ' ' ASN . 65.9 t30 -128.62 -46.4 1.3 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.094 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.407 ' O ' HG22 ' A' ' 186' ' ' VAL . 53.7 tp -62.99 -36.98 85.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.505 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -51.45 -34.96 37.57 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.572 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -66.03 -50.59 63.69 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -61.83 -47.97 82.69 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.022 0.439 . . . . 0.0 111.686 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.407 HG22 ' O ' ' A' ' 182' ' ' LEU . 23.0 m -66.59 -32.97 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.253 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -59.67 -48.99 79.48 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.506 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.6 t -61.41 -42.75 99.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.76 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 88.5 mt -63.57 -38.62 91.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.365 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -52.27 -29.57 23.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.522 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -71.83 133.27 45.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.851 0.358 . . . . 0.0 110.532 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 54.28 34.2 19.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.425 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 193' ' ' GLY . . . . . 0.433 ' O ' ' O ' ' A' ' 194' ' ' MET . . . -83.14 -173.52 49.73 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 194' ' ' MET . . . . . 0.433 ' O ' ' O ' ' A' ' 193' ' ' GLY . 81.4 mmm 56.17 158.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.908 0.385 . . . . 0.0 110.42 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 . . . . . 0 C--O 1.219 -0.552 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.459 -179.797 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.2 p30 -83.53 -2.69 56.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.876 0.37 . . . . 0.0 110.524 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -64.1 -39.78 94.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.524 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.0 t -102.37 123.65 46.54 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.393 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.9 t -159.03 158.8 33.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.463 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 32.1 p-80 -149.25 148.8 30.0 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.544 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 85.1 p -74.63 160.07 31.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.331 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 23.9 mmt85 -92.17 129.96 38.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.048 0.451 . . . . 0.0 110.645 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.579 HD22 ' N ' ' A' ' 69' ' ' LEU . 3.7 mm? -81.57 148.39 29.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.433 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -38.89 -88.32 0.01 OUTLIER Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.8 ttt-85 -155.81 97.83 1.86 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.866 0.365 . . . . 0.0 110.394 179.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.591 ' C ' ' H ' ' A' ' 74' ' ' ALA . 19.8 pt -137.23 171.74 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.162 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 61.05 -7.78 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.82 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.591 ' H ' ' C ' ' A' ' 72' ' ' ILE . . . -66.63 -35.48 80.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.555 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.6 p30 -92.1 13.87 17.64 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.572 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 94.7 p -55.67 -24.52 34.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.635 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.442 ' OE1' ' O ' ' A' ' 74' ' ' ALA . 57.7 mp0 -61.52 -36.22 79.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.28 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.3 m -122.78 113.36 19.08 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.067 0.461 . . . . 0.0 110.185 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -65.33 -34.16 77.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.67 -33.74 76.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -61.91 -35.6 78.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.068 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.406 ' O ' HG22 ' A' ' 86' ' ' ILE . 95.6 mt -62.48 -45.42 98.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.216 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.533 ' O ' ' HB2' ' A' ' 87' ' ' ALA . 97.2 mt -65.99 -41.55 89.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.241 0.543 . . . . 0.0 110.388 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -69.12 -44.62 72.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.435 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -61.12 -56.18 23.88 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.035 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.473 HG23 ' N ' ' A' ' 87' ' ' ALA . 18.8 tt -61.47 -41.19 89.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.441 0.639 . . . . 0.0 109.756 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 83' ' ' ILE . . . -51.02 -40.21 57.67 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -68.58 -44.38 74.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.34 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -62.83 -50.34 71.34 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.8 mt -52.13 -39.82 60.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.126 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.96 -49.04 79.07 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.857 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.74 -50.77 55.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.284 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.473 HG22 HH21 ' A' ' 99' ' ' ARG . 87.3 t -60.23 -42.32 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.193 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -53.96 -43.42 71.8 Favored Glycine 0 CA--C 1.519 0.335 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -76.2 -47.16 25.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.542 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 98' ' ' ASP . 18.3 m -61.16 -71.8 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.532 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 73.7 mmm 66.07 -41.65 0.36 Allowed 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.693 0.621 . . . . 0.0 110.656 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.52 ' H ' ' C ' ' A' ' 96' ' ' SER . 68.2 t0 -61.88 -40.07 94.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.489 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.473 HH21 HG22 ' A' ' 93' ' ' VAL . 71.8 ttp85 -64.66 -43.36 93.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.401 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.453 ' O ' ' C ' ' A' ' 101' ' ' ILE . 51.5 m -80.39 -127.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.381 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.453 ' C ' ' O ' ' A' ' 100' ' ' SER . 1.0 OUTLIER -28.65 93.46 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.467 0 O-C-N 123.616 0.573 . . . . 0.0 111.005 -179.872 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.433 ' N ' ' O ' ' A' ' 100' ' ' SER . 52.4 Cg_exo -48.99 166.66 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.244 1.962 . . . . 0.0 112.399 -178.217 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.468 ' C ' ' H ' ' A' ' 105' ' ' LEU . 51.8 Cg_exo -53.74 146.59 44.18 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.335 2.023 . . . . 0.0 111.866 178.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.558 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . -69.19 43.65 0.41 Allowed Glycine 0 CA--C 1.521 0.461 0 N-CA-C 110.801 -0.92 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.56 HD22 ' N ' ' A' ' 105' ' ' LEU . 3.7 mm? 58.55 -2.18 0.09 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.558 ' H ' ' C ' ' A' ' 104' ' ' GLY . 13.8 p -70.77 -35.06 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.563 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -61.12 -40.84 95.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.509 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.13 -51.18 58.56 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 60.4 tp -62.86 -42.6 99.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.543 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.4 -48.48 81.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 tp -64.82 -45.06 87.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.742 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -67.77 -26.9 66.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.667 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.432 ' O ' ' OG1' ' A' ' 116' ' ' THR . 57.1 tp -61.51 -43.0 99.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.135 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -59.79 -34.11 72.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.836 0.351 . . . . 0.0 110.369 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -58.74 -40.37 83.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.224 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 113' ' ' LEU . 45.5 p -72.58 -20.7 61.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.489 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 52.4 p -89.78 7.55 36.34 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.474 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -59.87 -42.39 93.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.475 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.5 m -62.0 146.4 50.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.519 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 52.72 76.99 0.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.416 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.564 ' C ' ' H ' ' A' ' 123' ' ' ARG . 97.4 mt-10 -78.68 -174.49 3.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.375 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.401 ' OD1' ' OD2' ' A' ' 126' ' ' ASP . 36.1 t70 56.8 -0.0 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.529 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.564 ' H ' ' C ' ' A' ' 121' ' ' GLU . 79.8 ttt180 -63.33 -44.47 94.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.526 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.548 ' O ' ' N ' ' A' ' 126' ' ' ASP . 78.8 m-20 -126.49 -72.47 0.65 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -52.73 84.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.239 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.548 ' N ' ' O ' ' A' ' 124' ' ' ASN . 26.1 t0 -163.84 -93.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.046 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 31.8 mt -52.8 -38.24 60.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.535 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.12 -47.84 71.4 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 81.8 m -62.36 -43.75 98.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.861 0.362 . . . . 0.0 110.455 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.96 -47.5 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.537 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -61.57 -42.43 98.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.404 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -64.03 -52.71 58.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.058 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -61.33 -44.62 96.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.683 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.31 -51.12 65.05 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.4 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' A' ' 135' ' ' LEU . 41.4 tp -57.72 -38.89 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.302 -178.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -56.69 -26.38 56.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.591 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -114.81 -130.64 0.31 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.004 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.572 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 46.5 t80 56.02 54.21 8.57 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 121.049 0.452 . . . . 0.0 110.677 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.437 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 57.0 Cg_endo -72.35 -13.75 28.05 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.557 2.172 . . . . 0.0 111.809 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -65.95 157.25 31.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.61 -179.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 56.12 29.22 14.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.614 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 50.1 mtt -149.77 -104.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.642 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -67.25 -32.66 73.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.598 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -58.38 -43.34 88.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.667 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -66.49 -51.87 52.11 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.545 ' O ' HG23 ' A' ' 150' ' ' VAL . 97.7 mttt -52.69 -40.9 63.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.313 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.5 m -59.83 -51.49 69.5 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.758 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 78.0 mtm -68.66 -40.0 80.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.017 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 62.9 mt -63.61 -43.18 97.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.691 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 146' ' ' LYS . 40.9 t -60.78 -44.73 98.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.217 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 54.4 tp -61.02 -46.74 89.51 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.51 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.43 -35.91 81.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.5 tp -70.28 -35.68 73.9 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.929 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.566 ' O ' HD13 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -61.18 -45.96 92.47 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.868 -178.871 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.32 -46.06 91.84 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.313 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.2 -45.18 74.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.535 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -64.25 -36.54 84.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.339 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.29 -47.17 86.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.276 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 96.0 t -64.93 -45.26 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.708 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -57.36 -48.55 78.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.26 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' SER . . . . . 0.506 ' C ' ' CG ' ' A' ' 162' ' ' HIS . 97.9 p -110.13 -133.11 0.33 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.559 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.506 ' CG ' ' C ' ' A' ' 161' ' ' SER . 0.1 OUTLIER -179.99 165.78 1.23 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.974 0.416 . . . . 0.0 109.953 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 4.6 p -73.02 149.76 89.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.65 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.68 -88.27 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.528 2.152 . . . . 0.0 112.307 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' SER . . . . . 0.49 ' O ' ' NE ' ' A' ' 168' ' ' ARG . 15.7 t -170.77 -121.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.607 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 36.7 mt -80.97 -6.66 59.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.497 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 50.4 mt -62.23 -33.33 74.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.372 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.497 ' CG ' ' N ' ' A' ' 169' ' ' ASP . 14.8 ptp180 -60.95 -45.61 94.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.519 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 169' ' ' ASP . . . . . 0.497 ' N ' ' CG ' ' A' ' 168' ' ' ARG . 67.1 t0 -65.26 -40.76 94.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.68 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.9 t -61.37 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.305 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -57.09 -47.29 81.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.46 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 29.1 t-80 -61.55 -37.02 82.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.22 0.533 . . . . 0.0 110.142 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 79.4 m -65.78 -43.23 89.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.764 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 96.3 m -58.44 -52.36 65.95 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.939 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.4 p -60.66 -38.17 77.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.06 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 176' ' ' ASN . . . . . 0.53 ' O ' ' NE2' ' A' ' 180' ' ' GLN . 6.9 m120 -61.89 -41.07 97.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -60.09 -46.55 89.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.399 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.545 HG22 HD22 ' A' ' 182' ' ' LEU . 53.2 mt -65.26 -43.24 95.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.01 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -51.11 -34.75 32.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.738 -179.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' GLN . . . . . 0.53 ' NE2' ' O ' ' A' ' 176' ' ' ASN . 0.6 OUTLIER -67.46 -15.24 63.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.638 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 181' ' ' ASN . . . . . 0.423 ' OD1' ' O ' ' A' ' 180' ' ' GLN . 99.7 m-20 -142.86 35.89 1.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.67 0.271 . . . . 0.0 110.372 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.575 HD13 ' O ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER -60.95 -44.37 97.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.077 0.465 . . . . 0.0 110.502 -178.786 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -57.18 -46.71 82.58 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.21 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 15.3 m -57.23 -43.3 82.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.328 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 185' ' ' TYR . . . . . 0.487 ' CD2' HG23 ' A' ' 178' ' ' ILE . 32.4 m-85 -66.05 -34.18 77.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.007 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 182' ' ' LEU . 43.7 t -59.91 -48.55 87.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.559 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -62.28 -52.73 62.55 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.147 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 96.5 p -57.99 -22.05 47.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.767 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.566 HD13 ' O ' ' A' ' 189' ' ' LEU . 0.2 OUTLIER -61.03 -46.8 89.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.352 -179.44 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -96.17 146.53 24.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.521 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -64.38 -36.58 84.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.46 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -89.41 105.25 17.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.607 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -66.06 -41.46 95.1 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 12.2 ttt -146.1 151.15 37.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.832 0.349 . . . . 0.0 110.571 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.521 179.818 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.418 -1.473 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -76.4 143.92 40.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.881 0.372 . . . . 0.0 110.812 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -94.8 128.12 41.3 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.406 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.499 ' O ' ' N ' ' A' ' 66' ' ' HIS . 34.9 t -152.88 137.14 16.56 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.822 0.344 . . . . 0.0 110.855 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.7 p 45.34 15.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.295 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.499 ' N ' ' O ' ' A' ' 64' ' ' SER . 29.9 m170 -87.97 -14.98 37.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.522 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 78.2 p -61.88 -34.99 77.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.41 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 78.0 ttt-85 -102.22 100.78 11.01 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.031 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 67.7 mt 41.06 65.17 0.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.478 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.08 -67.62 1.93 Allowed Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.0 ttp85 -94.24 101.33 13.3 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.559 ' O ' ' N ' ' A' ' 74' ' ' ALA . 96.3 mt -93.66 111.03 24.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 53.09 -81.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.559 ' N ' ' O ' ' A' ' 72' ' ' ILE . . . -178.56 -3.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.411 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.425 ' H ' ' H ' ' A' ' 74' ' ' ALA . 90.1 m-20 -84.75 1.59 45.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.97 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 90.7 p -58.75 -42.85 89.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.802 0.334 . . . . 0.0 110.54 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -71.98 -35.04 69.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.642 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.0 m -85.64 20.52 2.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.361 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -52.3 -29.63 24.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.588 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.26 -38.98 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.44 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.06 -43.54 98.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 87.9 mt -63.02 -43.16 98.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.615 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.1 mt -61.34 -42.4 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -54.01 -54.69 35.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -54.79 -40.17 69.19 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.687 0.279 . . . . 0.0 110.427 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.41 HD13 ' HA ' ' A' ' 86' ' ' ILE . 29.0 mm -64.49 -46.36 92.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.323 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.7 90.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.649 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -59.4 -48.96 79.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.823 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -66.79 -40.54 88.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.089 0.471 . . . . 0.0 110.118 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.542 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.2 tt -67.24 -37.43 83.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.511 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.59 -47.8 83.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.75 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -64.74 -52.17 58.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.554 -0.459 . . . . 0.0 110.153 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.88 -26.74 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.578 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -76.14 -31.28 55.61 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -61.76 -46.98 87.24 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p -66.48 -32.05 73.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.554 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 60.8 ttp -61.35 -36.18 79.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.388 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.54 -17.22 59.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.939 0.4 . . . . 0.0 110.314 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -59.38 -44.92 92.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.072 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t -123.02 115.18 21.45 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.139 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.655 ' O ' HG23 ' A' ' 101' ' ' ILE . 16.5 tt -171.13 79.52 0.53 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.623 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.488 ' O ' ' N ' ' A' ' 104' ' ' GLY . 23.3 Cg_exo -62.82 156.35 54.27 Favored 'Trans proline' 0 C--N 1.302 -1.904 0 C-N-CA 122.532 2.155 . . . . 0.0 112.197 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.535 ' O ' ' N ' ' A' ' 105' ' ' LEU . 37.0 Cg_exo -42.45 -18.31 0.09 OUTLIER 'Trans proline' 0 C--N 1.311 -1.447 0 C-N-CA 122.752 2.301 . . . . 0.0 111.738 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 102' ' ' PRO . . . 59.55 -75.67 0.01 OUTLIER Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.042 -0.823 . . . . 0.0 111.042 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.684 ' N ' HD23 ' A' ' 105' ' ' LEU . 1.8 pt? -179.24 -25.19 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.905 0.383 . . . . 0.0 110.825 -178.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 66.2 t -58.93 -46.13 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.403 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -59.87 -45.05 93.72 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.087 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -77.15 -22.66 70.54 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.457 ' N ' ' O ' ' A' ' 105' ' ' LEU . 53.4 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.325 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.04 -48.07 77.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.322 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.76 -43.36 93.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.428 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -44.86 75.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.258 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 tp -63.51 -44.64 93.7 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.388 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -51.37 -38.28 52.5 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.86 -51.55 54.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.046 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 21.0 m -66.83 -47.29 72.47 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.311 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.1 m -54.44 98.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.473 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.8 mtp85 -137.45 -121.53 0.14 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.291 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 46.5 m -59.62 -38.68 81.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.422 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -65.32 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.829 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 57.57 41.67 25.35 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.441 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -152.18 -9.87 0.19 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.536 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -82.45 -80.21 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.256 -179.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -64.2 -41.48 97.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.072 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.49 54.69 0.76 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.043 0.449 . . . . 0.0 110.313 -179.706 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -130.97 -75.07 0.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.427 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.0 -33.5 75.87 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.55 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -44.15 71.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.087 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.8 m -60.33 -51.41 69.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.19 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.27 -46.39 80.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.159 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 36.7 tp -61.58 -43.35 99.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.567 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -62.41 -51.56 67.05 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.387 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mm-40 -60.87 -39.86 90.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.141 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.2 tp -61.55 -51.39 68.76 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.781 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.574 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -59.64 -38.13 80.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.299 0.571 . . . . 0.0 110.44 -177.808 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -56.43 -25.6 50.85 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.312 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -156.07 98.05 1.85 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.566 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.575 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 6.7 p90 -141.43 68.49 26.06 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-O 121.526 0.679 . . . . 0.0 110.352 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -51.9 -37.61 67.02 Favored 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 122.462 2.108 . . . . 0.0 112.439 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.432 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 74.9 mtp180 42.62 -112.28 0.2 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.62 -179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 140' ' ' ARG . 97.7 m-20 -141.93 106.3 4.82 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.542 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 10.7 ptm -154.84 -34.94 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.604 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -64.41 -37.89 89.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 0.0 110.141 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -64.15 -46.01 85.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.033 0.444 . . . . 0.0 110.066 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -55.28 -30.16 59.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.64 -178.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 150' ' ' VAL . 97.4 mttt -69.13 -43.73 73.78 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.214 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.429 ' O ' ' CB ' ' A' ' 151' ' ' LEU . 84.2 m -69.96 -36.02 74.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.537 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.4 mtt -60.27 -46.03 91.23 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.02 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.3 mp -73.25 -50.6 21.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.43 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 146' ' ' LYS . 79.1 t -60.56 -45.74 96.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.498 -178.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.429 ' CB ' ' O ' ' A' ' 147' ' ' THR . 56.6 tp -58.05 -44.72 87.58 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.496 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.87 -36.7 82.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.516 ' CG ' ' HZ3' ' A' ' 157' ' ' LYS . 38.5 tp -63.67 -42.05 98.11 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.912 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.34 -42.42 95.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.414 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.22 -40.24 96.9 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.75 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.16 -39.02 69.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.269 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.516 ' HZ3' ' CG ' ' A' ' 153' ' ' LEU . 31.2 mttp -62.73 -44.68 95.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.834 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.7 -44.21 97.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.457 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 80.7 t -65.48 -43.06 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.085 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -60.15 -47.63 85.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.81 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 74.5 m -167.89 168.12 12.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.39 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -117.92 127.04 53.47 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.989 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.46 156.91 59.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.643 -179.27 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -69.67 157.59 60.04 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.954 2.436 . . . . 0.0 112.537 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 54.8 m -83.18 -33.39 26.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.056 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 73.2 mt -60.64 -53.46 57.24 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 110.754 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 167' ' ' LEU . 0.2 OUTLIER -62.19 -41.79 98.67 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.89 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -59.08 -43.32 91.77 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.221 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.98 -43.28 99.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.677 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.452 ' O ' ' OG1' ' A' ' 173' ' ' THR . 96.4 t -62.88 -43.34 98.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.066 0.46 . . . . 0.0 110.221 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -56.29 -49.24 74.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -61.86 -45.35 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.544 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 19.4 p -58.37 -45.69 87.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.195 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -54.04 -45.71 71.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 110.272 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 86.0 t -61.13 -44.42 98.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.782 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -60.93 -39.56 89.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.499 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -59.46 -42.46 92.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.492 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 96.6 mt -61.99 -41.45 91.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.683 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -59.35 -34.54 72.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.6 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -65.8 -48.44 71.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.979 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -106.68 48.56 0.83 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.95 0.405 . . . . 0.0 110.371 -179.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp -63.95 -41.19 97.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.824 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -60.11 -45.59 92.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.245 0.545 . . . . 0.0 110.021 -179.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -57.18 -44.62 83.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.809 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -58.17 -39.7 79.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.58 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.5 t -58.43 -50.2 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.035 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -68.47 -45.84 71.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.299 0.571 . . . . 0.0 110.745 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 23.6 p -58.64 -35.07 71.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.998 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.611 ' O ' ' HB3' ' A' ' 190' ' ' ALA . 85.3 mt -99.37 30.06 3.7 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.266 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 190' ' ' ALA . . . . . 0.611 ' HB3' ' O ' ' A' ' 189' ' ' LEU . . . 80.23 116.04 0.06 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.037 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 8.8 tmm_? -76.11 135.05 39.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.874 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.42 ' OD1' ' O ' ' A' ' 192' ' ' ASN . 46.1 p-10 -103.55 134.94 46.07 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.761 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -158.74 26.78 0.4 Allowed Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 95.9 mtp 45.59 41.7 7.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.812 0.339 . . . . 0.0 110.574 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 . . . . . 0 C--O 1.221 -0.429 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.695 179.994 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -140.63 115.46 9.65 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.814 0.34 . . . . 0.0 110.526 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -148.27 171.25 16.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.56 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.466 ' OG ' ' N ' ' A' ' 65' ' ' SER . 87.9 p 48.86 -96.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.803 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.466 ' N ' ' OG ' ' A' ' 64' ' ' SER . 24.3 p 58.41 95.71 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.532 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -75.84 137.14 40.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.323 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.7 t -164.49 40.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.894 0.378 . . . . 0.0 110.597 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -63.64 -38.14 89.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.781 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.57 ' H ' HD23 ' A' ' 69' ' ' LEU . 0.1 OUTLIER -74.22 146.82 43.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.021 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' A' ' 69' ' ' LEU . . . -60.56 -140.99 0.01 OUTLIER Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.432 ' O ' ' O ' ' A' ' 72' ' ' ILE . 94.0 mtm-85 -92.4 9.47 34.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.771 0.32 . . . . 0.0 110.283 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.677 ' C ' ' H ' ' A' ' 74' ' ' ALA . 4.0 mm -60.59 -140.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.915 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.579 ' H ' HG22 ' A' ' 72' ' ' ILE . 81.2 tt0 62.35 -24.26 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.827 -179.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.677 ' H ' ' C ' ' A' ' 72' ' ' ILE . . . -60.27 -156.88 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 110.32 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 49.79 20.34 0.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.452 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.2 p -61.48 -24.63 66.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.393 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -62.63 -39.35 93.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.538 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.1 m -109.75 94.91 5.27 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.916 0.389 . . . . 0.0 110.498 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -60.66 -31.52 70.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.952 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -66.89 -36.61 82.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.449 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -61.52 -45.27 94.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.158 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.453 ' O ' HG22 ' A' ' 86' ' ' ILE . 96.6 mt -65.08 -44.38 95.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.354 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.405 ' O ' ' HB2' ' A' ' 87' ' ' ALA . 97.2 mt -66.07 -41.11 88.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.253 0.549 . . . . 0.0 110.27 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -70.61 -50.31 38.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.851 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -52.91 -55.09 25.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.303 -178.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.535 HG23 ' N ' ' A' ' 87' ' ' ALA . 21.0 tt -63.29 -44.61 99.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.724 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.535 ' N ' HG23 ' A' ' 86' ' ' ILE . . . -51.13 -39.38 56.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.955 -178.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -65.26 -49.79 68.26 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.411 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -66.94 -52.15 46.47 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 120.337 -0.545 . . . . 0.0 109.896 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.421 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.6 tt -52.84 -38.48 61.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.114 -179.049 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.67 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.748 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -67.76 -46.01 73.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.854 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 96' ' ' SER . 69.3 t -66.23 -40.38 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.195 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -55.78 -42.91 86.7 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -61.69 -47.48 85.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.199 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 93' ' ' VAL . 46.7 t -109.07 110.8 22.15 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.075 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.435 ' O ' ' O ' ' A' ' 98' ' ' ASP . 10.8 ttm -64.95 -11.34 37.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.924 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.488 ' O ' ' N ' ' A' ' 100' ' ' SER . 98.8 m-20 -53.29 -167.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 51.5 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.154 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 98' ' ' ASP . 48.1 t -77.56 82.74 3.98 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.685 ' O ' HG23 ' A' ' 101' ' ' ILE . 15.3 tt -119.82 83.9 30.46 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.521 ' N ' ' CD ' ' A' ' 103' ' ' PRO . 23.4 Cg_exo -53.73 -40.61 79.23 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 122.006 1.804 . . . . 0.0 111.71 178.075 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 102' ' ' PRO . 64.4 Cg_endo -81.39 -168.49 0.63 Allowed 'Trans proline' 0 N--CA 1.488 1.159 0 C-N-CA 122.121 1.881 . . . . 0.0 112.247 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.96 4.45 90.0 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 77.7 mt -63.28 -42.62 99.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.735 0.302 . . . . 0.0 110.978 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -34.56 62.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.066 0.46 . . . . 0.0 110.467 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.33 -41.6 98.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.174 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.83 -42.24 59.42 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.599 HD23 ' O ' ' A' ' 109' ' ' LEU . 3.1 tt -60.75 -48.45 81.73 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.994 0.426 . . . . 0.0 110.041 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.78 93.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.526 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.611 HD23 ' O ' ' A' ' 111' ' ' LEU . 2.9 tt -63.31 -47.56 81.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.943 0.401 . . . . 0.0 110.165 -179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.86 -39.71 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.307 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.23 -42.31 99.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.402 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -64.8 -38.08 89.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.17 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.13 -37.97 75.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.155 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 20.2 m -60.69 -44.68 96.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.497 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t -96.32 79.27 3.11 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.975 0.417 . . . . 0.0 110.175 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -64.04 -39.95 95.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.644 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.9 m -54.7 -40.07 68.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.652 -179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -76.1 55.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.453 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -173.02 -53.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.471 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 122' ' ' ASP . 67.8 t0 -53.87 -31.93 51.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.19 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -54.51 -77.02 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.565 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.463 ' O ' ' N ' ' A' ' 126' ' ' ASP . 80.8 m-20 -63.3 -40.61 97.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.318 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -65.16 73.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.486 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' A' ' 124' ' ' ASN . 64.2 t0 -146.64 -90.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.148 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 60.2 mt -52.01 -33.13 37.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.672 0.272 . . . . 0.0 110.577 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.41 -49.62 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.817 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 15.5 m -62.95 -42.72 99.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.334 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.46 -46.92 80.13 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.0 mt -58.93 -41.26 86.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -54.94 -52.43 63.02 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.707 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -51.98 -47.91 64.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.107 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.556 ' O ' HD13 ' A' ' 134' ' ' LEU . 0.2 OUTLIER -64.1 -42.89 96.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.512 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -56.63 -47.69 79.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.036 -178.806 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -56.48 -29.78 62.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.214 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ALA . . . . . 0.423 ' O ' ' O ' ' A' ' 134' ' ' LEU . . . -107.79 97.7 7.38 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.408 ' C ' ' O ' ' A' ' 137' ' ' ALA . 2.0 t80 -38.21 131.96 0.98 Allowed Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.998 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -44.94 -46.69 12.75 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.035 1.823 . . . . 0.0 112.246 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.415 ' O ' ' CB ' ' A' ' 141' ' ' ASP . 97.1 mtt180 -45.47 -91.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.681 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.519 ' C ' ' H ' ' A' ' 143' ' ' GLU . 2.0 t70 75.08 7.01 4.23 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.083 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.7 26.1 0.07 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.01 0.433 . . . . 0.0 110.041 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.519 ' H ' ' C ' ' A' ' 141' ' ' ASP . 82.2 tt0 -66.84 -40.96 88.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.479 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -60.84 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.199 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -72.59 -52.52 15.15 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.992 -0.683 . . . . 0.0 109.289 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -52.36 -39.7 61.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.236 -179.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 70.6 m -63.64 -44.17 94.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.617 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 18.9 mtm -62.89 -38.75 92.14 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.577 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.12 -41.79 99.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.076 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 75.8 t -63.39 -42.54 96.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.623 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.82 -45.26 90.38 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.195 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.41 -31.56 72.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.306 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 10.1 tp -71.98 -41.32 67.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.896 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.994 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.46 -44.09 95.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.17 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.8 -40.67 79.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.016 0.436 . . . . 0.0 110.312 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -64.2 -42.72 96.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.045 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.29 -45.12 94.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.308 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 70.5 t -62.29 -45.81 97.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.16 -41.43 97.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.767 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 28.8 t -142.97 145.14 32.69 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.366 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 35.8 m80 -68.64 -139.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.479 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 5.3 p -140.05 150.57 62.51 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.081 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.445 ' O ' ' CB ' ' A' ' 165' ' ' SER . 44.2 Cg_exo -41.96 -64.58 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 122.232 1.955 . . . . 0.0 112.565 179.557 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 165' ' ' SER . . . . . 0.451 ' C ' ' H ' ' A' ' 167' ' ' LEU . 1.5 m 165.48 -167.82 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.311 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.533 HD12 ' N ' ' A' ' 166' ' ' LEU . 10.8 mp -67.05 4.13 0.96 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.407 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.451 ' H ' ' C ' ' A' ' 165' ' ' SER . 58.0 mt -61.36 -31.7 71.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.262 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -65.06 -42.48 94.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 0.0 110.626 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -64.87 -43.84 91.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.658 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.9 t -61.19 -45.65 98.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.097 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -57.29 -42.91 82.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.097 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -59.78 -40.57 88.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.605 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 20.1 m -59.84 -44.89 93.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -59.36 -45.93 90.04 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 110.639 -179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.09 -44.53 95.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.146 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -61.9 -38.84 89.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.541 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 177' ' ' PHE . . . . . 0.562 ' CE2' ' CD2' ' A' ' 182' ' ' LEU . 86.1 t80 -57.21 -47.94 80.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.354 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.599 ' O ' ' N ' ' A' ' 183' ' ' ARG . 63.2 mt -64.9 -42.3 94.46 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.327 0 CA-C-O 121.053 0.454 . . . . 0.0 110.04 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.539 ' O ' ' N ' ' A' ' 181' ' ' ASN . 60.3 t-20 -59.26 -34.07 71.81 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.789 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 180' ' ' GLN . . . . . 0.604 ' C ' ' H ' ' A' ' 182' ' ' LEU . 48.2 tt0 -59.08 70.84 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.634 -179.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 181' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 179' ' ' ASN . 6.3 m120 62.5 -20.35 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.604 ' H ' ' C ' ' A' ' 180' ' ' GLN . 9.3 mp -63.3 -37.3 86.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.804 0.335 . . . . 0.0 110.175 179.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 183' ' ' ARG . . . . . 0.599 ' N ' ' O ' ' A' ' 178' ' ' ILE . 41.5 ttm180 -57.36 -36.88 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.5 m -59.69 -51.03 71.51 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.733 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -66.83 -39.86 87.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.113 0.482 . . . . 0.0 110.691 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.24 -39.65 83.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.332 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -61.23 -44.62 96.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.644 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 72.3 m -58.49 -38.31 77.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.361 . . . . 0.0 110.391 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 57.3 tp -70.46 98.72 1.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.204 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 190' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 193' ' ' GLY . . . -172.66 -35.43 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.634 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -64.88 -42.09 95.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.762 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 44.4 t30 -61.9 -40.22 94.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.863 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 193' ' ' GLY . . . . . 0.424 ' O ' ' O ' ' A' ' 190' ' ' ALA . . . -151.99 158.44 27.79 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 8.7 ptp -149.14 160.02 43.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 110.368 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.596 179.854 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.424 ' O ' ' OG ' ' A' ' 65' ' ' SER . 98.2 m-20 -62.25 -41.19 98.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.813 0.34 . . . . 0.0 110.634 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 80.5 mtp85 -78.55 147.57 33.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.5 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.5 m 52.4 27.24 4.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.682 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 67.7 m -59.95 -39.31 85.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.46 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 62.0 m80 48.79 26.1 1.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.573 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 79.3 p -56.52 -32.16 64.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.286 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -78.47 140.93 38.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.284 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.589 HD12 ' N ' ' A' ' 69' ' ' LEU . 9.8 mp -76.51 142.94 40.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.526 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.29 38.1 0.82 Allowed Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.467 ' H ' ' C ' ' A' ' 69' ' ' LEU . 22.9 mmt85 51.96 63.18 2.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.971 0.415 . . . . 0.0 110.422 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.431 ' C ' ' H ' ' A' ' 74' ' ' ALA . 17.8 tt -66.11 -33.13 61.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.417 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.452 ' O ' ' O ' ' A' ' 74' ' ' ALA . 96.9 mt-10 -54.11 -10.21 0.33 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.493 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.555 ' O ' ' N ' ' A' ' 76' ' ' SER . . . -59.17 -129.48 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.546 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 54.74 -80.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.498 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.555 ' N ' ' O ' ' A' ' 74' ' ' ALA . 27.3 t -44.98 99.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.601 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 48.25 24.64 0.71 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.552 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 56.2 p 40.78 36.36 0.4 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.683 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -47.37 -29.94 2.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.555 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -67.2 -33.87 76.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.689 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -55.72 -46.79 77.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.522 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.672 HD12 ' N ' ' A' ' 82' ' ' ILE . 2.0 mp -62.79 -46.04 97.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.357 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 97.2 mt -62.11 -43.04 97.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.684 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.3 ttt85 -50.97 -49.96 59.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.643 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -56.46 -43.85 79.95 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.632 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.89 -50.1 81.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.456 -0.497 . . . . 0.0 109.722 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.1 89.85 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -57.8 -48.5 79.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.67 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -66.75 -40.42 88.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.158 0.504 . . . . 0.0 110.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 94' ' ' GLY . 5.9 tt -66.91 -38.87 87.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.625 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.405 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -59.97 -42.02 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.628 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -65.41 -52.51 52.82 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.921 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.5 t -69.66 -26.08 29.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.815 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -85.5 -37.36 9.71 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.224 -0.75 . . . . 0.0 111.224 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.455 ' O ' ' O ' ' A' ' 96' ' ' SER . 42.7 t0 -72.05 -46.46 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.614 0.245 . . . . 0.0 110.941 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.457 ' C ' ' H ' ' A' ' 98' ' ' ASP . 70.9 m -57.62 -123.22 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.917 0.389 . . . . 0.0 111.034 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.6 ttt 62.66 1.44 0.79 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.035 0.445 . . . . 0.0 110.251 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.457 ' H ' ' C ' ' A' ' 96' ' ' SER . 43.5 t0 -62.74 -37.59 87.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.512 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -66.98 135.48 53.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.537 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 t 44.4 89.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.472 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.754 ' O ' HG23 ' A' ' 101' ' ' ILE . 9.3 tp -159.69 66.17 2.71 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.168 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.517 ' N ' ' CD ' ' A' ' 103' ' ' PRO . 31.9 Cg_exo -49.1 -39.8 41.51 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 121.936 1.758 . . . . 0.0 111.998 178.32 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.517 ' CD ' ' N ' ' A' ' 102' ' ' PRO . 31.7 Cg_exo -59.18 -158.28 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 122.222 1.948 . . . . 0.0 112.183 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.71 -2.69 84.69 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.568 HD12 ' N ' ' A' ' 105' ' ' LEU . 9.9 mp -89.31 -11.53 43.15 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.909 0.385 . . . . 0.0 110.296 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.36 -32.75 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.735 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.423 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 56.5 t-20 -60.32 -30.19 69.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.14 0.495 . . . . 0.0 110.518 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -64.42 -47.72 81.38 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.631 ' N ' HD22 ' A' ' 109' ' ' LEU . 3.5 mm? -62.91 -38.52 91.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.719 0.295 . . . . 0.0 110.708 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.99 73.31 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.236 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.608 HD23 ' O ' ' A' ' 111' ' ' LEU . 2.6 tt -70.63 -48.09 56.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -61.79 -25.49 67.51 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.689 -179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.41 ' N ' ' O ' ' A' ' 109' ' ' LEU . 58.6 tp -60.22 -43.11 96.27 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.17 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.59 -42.64 98.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.576 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -65.46 -43.37 90.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.686 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.9 m -64.23 -46.98 81.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.66 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 3.7 m -88.67 57.12 4.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.488 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -61.25 -38.71 87.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.485 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.1 m -80.92 -96.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.429 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 40.65 77.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.592 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -167.52 -178.27 3.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.636 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 55.96 33.94 22.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.644 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -136.38 -40.54 0.65 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.557 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -153.41 12.17 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.696 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -105.63 -34.78 7.63 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.433 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -45.65 -85.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.688 -179.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.3 pp -50.76 -32.22 19.13 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.983 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.76 -48.24 69.91 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.972 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 8.4 m -60.2 -38.6 83.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.085 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -47.55 78.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.15 -44.43 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.479 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.86 -51.03 68.6 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.891 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -54.82 -37.88 66.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.598 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.8 tp -60.04 -51.14 70.92 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.28 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.11 -44.22 97.68 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.3 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -58.46 -37.63 75.85 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 138' ' ' TYR . . . -66.73 -76.35 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.321 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.43 ' C ' ' O ' ' A' ' 137' ' ' ALA . 55.9 t80 -32.7 99.5 0.15 Allowed Pre-proline 0 CA--C 1.54 0.565 0 O-C-N 123.147 0.279 . . . . 0.0 111.054 -179.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -79.75 168.44 19.4 Favored 'Trans proline' 0 C--N 1.313 -1.291 0 C-N-CA 122.127 1.885 . . . . 0.0 111.975 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.553 ' H ' ' HD3' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -82.49 35.02 0.44 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.309 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -81.37 90.41 6.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.3 mtt -98.67 16.14 22.98 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.412 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -59.99 -42.52 94.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.415 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.31 -33.54 73.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.654 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -70.2 -44.2 69.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.375 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.4 ' O ' HG23 ' A' ' 150' ' ' VAL . 53.7 mtmt -66.5 -39.46 88.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.736 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 72.5 m -59.7 -43.3 94.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.444 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 49.2 mtt -61.15 -45.97 92.45 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.152 -179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.33 -50.36 33.16 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.516 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 146' ' ' LYS . 71.0 t -58.73 -43.41 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.095 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.37 -45.92 90.11 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.48 82.39 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.916 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.61 -39.93 77.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.452 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.41 -41.72 90.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.61 -44.61 95.87 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.017 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.78 78.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.998 0.428 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 161' ' ' SER . 0.9 OUTLIER -60.27 -45.71 92.36 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.858 -179.244 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.55 -37.71 87.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.588 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 97.2 t -69.11 -51.72 40.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.692 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -72.53 -50.54 25.01 Favored 'General case' 0 C--O 1.218 -0.578 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.184 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' SER . . . . . 0.502 ' N ' ' O ' ' A' ' 157' ' ' LYS . 78.2 p 24.18 35.02 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.171 0.51 . . . . 0.0 111.165 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.692 ' N ' ' O ' ' A' ' 160' ' ' ALA . 5.7 p80 -155.98 137.99 14.52 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.389 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.1 m -162.62 128.22 2.22 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.22 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -44.16 -31.38 4.08 Favored 'Trans proline' 0 N--CA 1.49 1.306 0 C-N-CA 121.85 1.7 . . . . 0.0 112.409 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 167' ' ' LEU . 1.1 m 73.66 -158.56 0.08 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 38.7 mt 65.29 -59.28 0.27 Allowed 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.654 0.596 . . . . 0.0 110.389 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.482 ' N ' ' O ' ' A' ' 165' ' ' SER . 85.5 mt -63.96 -31.71 72.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.234 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.43 -42.04 79.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.046 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -60.7 -47.09 87.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.081 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.422 HG23 ' N ' ' A' ' 171' ' ' PHE . 27.8 m -70.71 -40.04 76.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.657 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 171' ' ' PHE . . . . . 0.45 ' O ' HG23 ' A' ' 175' ' ' VAL . 86.3 t80 -58.53 -45.41 88.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.52 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -47.13 79.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.665 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.88 -39.9 91.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.611 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 71.2 m -60.41 -44.6 95.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.876 0.369 . . . . 0.0 110.443 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 175' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 171' ' ' PHE . 73.0 t -63.72 -40.6 89.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.549 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -64.69 -42.34 95.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.269 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 93.8 t80 -63.75 -52.34 60.86 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.826 0.346 . . . . 0.0 111.653 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 20.3 tt -68.8 -35.3 68.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.547 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.415 ' O ' ' CB ' ' A' ' 183' ' ' ARG . 0.8 OUTLIER -49.71 -34.46 18.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.575 -179.699 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 180' ' ' GLN . . . . . 0.404 ' C ' ' O ' ' A' ' 179' ' ' ASN . 88.1 mt-30 -37.86 -43.01 0.65 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.671 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -104.62 -44.85 4.78 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.811 0.339 . . . . 0.0 111.272 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' ' 182' ' ' LEU . 4.1 mm? -60.97 -36.57 79.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.551 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 183' ' ' ARG . . . . . 0.415 ' CB ' ' O ' ' A' ' 179' ' ' ASN . 64.0 ttm-85 -51.89 -42.29 62.59 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.726 -179.258 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.4 m -61.44 -52.3 65.13 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.689 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.64 -40.81 76.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.83 0.348 . . . . 0.0 110.808 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.72 -43.77 96.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.316 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.0 ttp85 -59.72 -53.04 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.613 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 21.4 m -63.22 -40.43 97.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 49.9 tp -42.02 -70.57 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.561 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -175.32 25.57 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.636 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 19.8 tpt85 -115.24 132.45 56.61 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.954 0.407 . . . . 0.0 110.429 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 55.43 41.47 30.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.404 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 193' ' ' GLY . . . . . 0.526 ' O ' ' N ' ' A' ' 195' ' ' ASP . . . -63.31 161.62 34.02 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 87.1 mmm 45.11 -89.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.693 0.283 . . . . 0.0 110.515 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 195' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 193' ' ' GLY . 53.3 t0 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.477 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 55.45 43.89 27.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.938 0.399 . . . . 0.0 110.502 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -58.46 -44.02 89.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.769 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.7 p 62.17 20.76 11.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.821 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 52.4 p -67.16 -33.49 75.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.715 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -91.46 93.95 9.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.427 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.9 t -85.99 -82.29 0.2 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.584 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -107.46 143.71 35.43 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.653 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.568 HD22 ' N ' ' A' ' 69' ' ' LEU . 3.8 mm? -88.72 1.65 54.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.484 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 90.75 -154.32 23.1 Favored Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -67.52 134.13 50.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.111 0.482 . . . . 0.0 110.355 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.454 HG13 ' H ' ' A' ' 75' ' ' ASP . 37.2 pt -152.74 -138.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.482 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -73.36 50.41 0.3 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.313 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.502 ' O ' ' N ' ' A' ' 76' ' ' SER . . . 61.85 22.01 12.69 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.895 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.454 ' H ' HG13 ' A' ' 72' ' ' ILE . 29.1 t0 41.11 22.97 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.92 0.39 . . . . 0.0 110.424 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.543 ' C ' ' H ' ' A' ' 78' ' ' SER . 7.1 t 40.64 38.96 0.68 Allowed 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.523 -179.499 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.498 ' O ' ' CB ' ' A' ' 78' ' ' SER . 75.3 tt0 69.32 -37.03 0.36 Allowed 'General case' 0 C--N 1.332 -0.171 0 O-C-N 123.919 0.762 . . . . 0.0 110.288 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.543 ' H ' ' C ' ' A' ' 76' ' ' SER . 1.2 p 158.48 0.19 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.522 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -66.06 -20.76 66.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.592 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.15 -38.7 80.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.459 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.65 -46.91 86.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.815 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.13 -43.75 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 -179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.74 -42.85 97.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -54.89 -47.32 74.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.658 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -62.02 -43.17 99.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.029 0.442 . . . . 0.0 110.516 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.7 mt -59.51 -44.25 92.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.72 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.74 -40.95 98.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.02 0.438 . . . . 0.0 110.243 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -54.65 -45.34 73.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.532 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -65.02 -41.45 95.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.603 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 94' ' ' GLY . 9.5 mt -66.43 -39.56 89.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.479 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.62 -46.46 77.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.184 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -61.68 -52.14 65.53 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.028 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.02 -25.84 36.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.7 -29.15 24.67 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.446 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.7 t70 -61.34 -45.84 92.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.785 0.326 . . . . 0.0 110.727 -179.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 90.0 p -136.45 104.91 5.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.934 0.397 . . . . 0.0 110.466 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 39.1 ttp -127.35 -16.86 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.373 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' A' ' 101' ' ' ILE . 98.5 m-20 -64.9 -31.5 72.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.575 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -65.09 -40.4 94.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.186 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m -60.57 -44.16 96.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.943 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.461 ' O ' ' O ' ' A' ' 98' ' ' ASP . 2.8 pt -99.81 149.53 36.02 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.066 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -36.64 104.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.352 0 C-N-CA 122.548 2.166 . . . . 0.0 112.12 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -77.87 179.52 6.42 Favored 'Trans proline' 0 C--N 1.314 -1.269 0 C-N-CA 122.243 1.962 . . . . 0.0 112.023 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 91.1 -16.27 59.05 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt -68.89 -32.55 72.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.871 0.367 . . . . 0.0 110.31 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 12.2 p -59.53 -32.9 50.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.532 -179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.9 -44.72 96.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.89 -41.09 91.34 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.76 -44.31 96.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.145 0.498 . . . . 0.0 110.401 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.04 93.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.61 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.402 ' O ' ' N ' ' A' ' 115' ' ' ASN . 63.7 mt -63.28 -41.49 99.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.628 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLN . . . . . 0.471 ' O ' HG22 ' A' ' 116' ' ' THR . 85.4 mm-40 -58.18 -47.34 83.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.455 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 64.6 tp -68.73 -43.46 75.87 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 121.544 0.688 . . . . 0.0 110.31 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.56 -37.52 86.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.216 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 111' ' ' LEU . 40.0 t30 -63.9 -44.35 93.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.028 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 112' ' ' GLN . 10.0 t -87.07 28.26 0.94 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.793 0.33 . . . . 0.0 110.416 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 84.7 p -78.84 -3.19 43.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.355 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 44.4 ptt85 -74.96 50.36 0.46 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.489 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.2 m 56.93 95.92 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.661 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 77.2 tt0 -168.6 64.45 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.113 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.489 ' C ' ' H ' ' A' ' 123' ' ' ARG . 7.0 pt-20 -179.02 -171.69 0.22 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.197 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 57.82 3.71 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.511 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.489 ' H ' ' C ' ' A' ' 121' ' ' GLU . 88.5 mtm180 -75.32 -71.31 0.37 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.476 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.475 ' O ' ' N ' ' A' ' 126' ' ' ASP . 99.1 m-20 -64.83 -39.55 93.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.451 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -66.18 66.92 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.45 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.475 ' N ' ' O ' ' A' ' 124' ' ' ASN . 65.1 t0 -134.18 -85.59 0.42 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.836 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 65.9 mt -54.49 -31.44 55.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.714 0.292 . . . . 0.0 110.671 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.16 -47.06 75.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.421 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 23.4 m -63.68 -44.21 94.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.9 -47.74 81.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.615 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.95 -41.16 95.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.415 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -61.7 -48.88 78.77 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.98 -44.61 95.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.658 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.78 -53.32 57.57 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.306 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.568 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -59.68 -38.92 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.463 -0.495 . . . . 0.0 109.857 -178.112 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -57.49 -36.97 72.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.624 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -117.3 62.6 0.74 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.743 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.665 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 1.9 t80 -84.88 -34.56 0.53 Allowed Pre-proline 0 CA--C 1.542 0.673 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.239 178.168 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.665 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 39.8 Cg_exo -55.79 108.9 0.36 Allowed 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.024 1.816 . . . . 0.0 111.75 -178.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.416 ' O ' ' N ' ' A' ' 142' ' ' MET . 20.3 ptp180 -153.72 152.3 30.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.248 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.524 ' O ' ' N ' ' A' ' 143' ' ' GLU . 99.7 m-20 43.53 -97.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.384 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' MET . . . . . 0.416 ' N ' ' O ' ' A' ' 140' ' ' ARG . 30.5 ttm 63.88 -65.33 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.527 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 147' ' ' THR . 22.6 pt-20 -53.87 -35.32 61.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.197 0.522 . . . . 0.0 110.718 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' LYS . . . . . 0.488 ' O ' ' OG1' ' A' ' 147' ' ' THR . 47.1 tttp -64.16 -34.82 78.96 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.281 0.563 . . . . 0.0 111.147 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.78 -48.9 65.04 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.773 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.452 ' O ' HG23 ' A' ' 150' ' ' VAL . 46.4 pttt -70.31 -31.69 69.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.004 0.43 . . . . 0.0 110.367 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' THR . . . . . 0.811 HG23 ' O ' ' A' ' 143' ' ' GLU . 12.2 p -60.11 -45.92 91.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.032 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mtm -62.49 -46.06 90.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.059 179.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' LEU . . . . . 0.419 HD22 ' N ' ' A' ' 149' ' ' LEU . 4.2 mm? -65.35 -47.41 76.55 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 119.591 -0.844 . . . . 0.0 110.256 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 146' ' ' LYS . 45.7 t -60.89 -41.08 87.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.561 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.1 tp -57.79 -45.21 86.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.629 -179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.01 -41.26 95.52 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.613 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.69 -43.51 98.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.607 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.9 mt -60.78 -43.54 97.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.161 0.505 . . . . 0.0 110.031 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.541 ' O ' HD13 ' A' ' 155' ' ' LEU . 0.2 OUTLIER -62.56 -44.48 96.24 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.685 -179.552 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.73 -35.99 75.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.495 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.14 -48.85 79.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.453 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -64.0 -40.72 97.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.916 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 155' ' ' LEU . 76.9 t -66.32 -46.11 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.931 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -66.06 -36.06 82.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.962 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.6 p -159.17 162.92 36.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.548 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -88.87 -161.61 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 12.9 p -84.95 147.84 49.26 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.973 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -41.48 -71.79 0.05 OUTLIER 'Trans proline' 0 N--CA 1.49 1.31 0 C-N-CA 122.284 1.99 . . . . 0.0 112.456 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' SER . . . . . 0.54 ' OG ' ' N ' ' A' ' 166' ' ' LEU . 4.9 t 170.59 -111.05 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.997 -179.4 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.54 ' N ' ' OG ' ' A' ' 165' ' ' SER . 85.6 mt -98.95 -7.75 26.56 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.009 0.433 . . . . 0.0 110.728 -179.806 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 167' ' ' LEU . 10.4 mp -65.91 -25.73 67.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.123 179.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -59.93 -41.99 92.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.698 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -68.25 -46.37 70.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.124 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.08 -45.94 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.473 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -60.05 -39.31 85.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.371 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.51 -49.25 78.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.348 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 23.8 m -61.07 -46.86 88.93 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.062 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.3 m -52.66 -42.42 64.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.125 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.4 -44.34 99.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.773 0.321 . . . . 0.0 110.688 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -70.88 -35.79 72.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -58.03 -42.15 84.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.41 -179.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.5 mt -60.84 -42.17 91.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.356 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 180' ' ' GLN . 25.4 m-20 -50.79 -34.19 26.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.985 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 180' ' ' GLN . . . . . 0.461 ' O ' ' O ' ' A' ' 179' ' ' ASN . 57.6 tt0 -35.13 -95.73 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.734 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -130.5 -12.5 3.91 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.63 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.48 ' O ' HG23 ' A' ' 186' ' ' VAL . 56.6 mt -61.95 -36.19 80.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.398 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -51.32 -45.78 62.36 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.965 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.1 m -62.63 -51.29 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.121 0.486 . . . . 0.0 110.008 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -62.08 -40.33 95.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.203 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 182' ' ' LEU . 42.0 t -62.7 -44.2 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.616 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 67.2 mmt-85 -58.05 -53.62 56.23 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.148 -178.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 69.1 m -58.56 -40.92 84.42 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.497 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 84.8 mt -86.27 84.37 7.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.386 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . 44.7 -165.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.431 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 10.5 ptp85 -141.02 147.21 38.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.372 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -90.49 108.44 19.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.666 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -62.33 -43.27 99.31 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 50.4 ttp -163.62 144.07 8.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.765 0.317 . . . . 0.0 110.607 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.542 179.897 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -63.53 -41.17 98.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.69 0.281 . . . . 0.0 110.834 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -87.65 138.33 31.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.563 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.3 p -79.6 65.78 4.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.561 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.9 p -77.29 161.57 28.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.514 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.498 ' CG ' ' N ' ' A' ' 67' ' ' SER . 16.5 t-80 -154.08 -101.23 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.572 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.498 ' N ' ' CG ' ' A' ' 66' ' ' HIS . 54.1 m -83.36 -8.19 59.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.692 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -63.59 -40.65 97.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.588 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.02 -42.17 99.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.612 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 58.45 -87.74 0.02 OUTLIER Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.412 ' HE ' ' HB2' ' A' ' 75' ' ' ASP . 33.4 ptt-85 -145.86 156.71 43.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.783 0.325 . . . . 0.0 110.668 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.5 tt -139.18 155.09 26.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.331 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 65.93 35.66 6.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.149 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -167.89 1.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.686 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.486 ' O ' ' N ' ' A' ' 77' ' ' GLU . 29.8 t70 -158.13 -106.07 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.402 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.402 ' N ' ' CG ' ' A' ' 75' ' ' ASP . 3.7 t 41.55 22.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.651 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.486 ' N ' ' O ' ' A' ' 75' ' ' ASP . 83.1 tt0 -139.65 75.06 1.49 Allowed 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.508 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.4 t 171.44 -37.54 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.428 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.49 -34.54 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.406 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -60.13 -39.51 86.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.325 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -62.12 -46.16 90.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.445 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.69 -43.73 93.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.604 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.2 mt -60.69 -41.73 89.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -58.36 -55.05 40.03 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.803 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -52.86 -52.25 57.99 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.668 -178.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.59 -51.21 73.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.043 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -57.36 -36.86 71.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.26 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -61.87 -45.91 91.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.526 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -66.02 -43.29 88.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.931 0.396 . . . . 0.0 110.14 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.558 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.8 mp -71.42 -33.69 69.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.048 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.486 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -56.9 -48.43 78.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.439 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -72.18 -52.54 16.07 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.906 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 88.3 t -66.68 -26.33 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 121.039 0.447 . . . . 0.0 110.745 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -75.97 -37.04 39.51 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.13 -47.6 79.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.495 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.3 p -106.16 106.67 17.29 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 110.383 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.462 ' SD ' ' O ' ' A' ' 97' ' ' MET . 2.3 tmm? -171.0 -32.6 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 98' ' ' ASP . 35.5 p-10 -65.67 -22.87 66.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.956 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -60.5 -38.57 84.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.7 t -62.92 -42.48 99.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.621 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 6.4 pt -144.33 76.34 14.75 Favored Pre-proline 0 N--CA 1.463 0.205 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.343 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -45.22 106.42 0.09 OUTLIER 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.434 2.089 . . . . 0.0 111.839 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.98 -163.93 0.25 Allowed 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.433 2.089 . . . . 0.0 112.274 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 87.32 -18.85 34.73 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.0 mt -66.78 -41.62 87.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.007 0.432 . . . . 0.0 110.383 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.45 HG22 ' H ' ' A' ' 106' ' ' VAL . 3.2 m -66.44 -37.74 80.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.71 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -62.43 -41.31 98.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 0.0 110.194 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -67.89 -48.72 53.11 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.34 -41.47 98.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.142 0.496 . . . . 0.0 110.335 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.46 -48.44 74.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.337 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.73 -43.11 97.49 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.615 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -61.78 -34.93 76.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.728 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 113' ' ' LEU . 40.0 mt -62.73 -42.68 99.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.31 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -78.12 -20.75 51.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.169 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -62.73 -34.79 77.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.307 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.2 m -60.11 -47.93 83.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.656 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.5 m -87.74 -76.25 0.38 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.914 0.388 . . . . 0.0 110.361 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 53.6 ttt-85 45.55 33.01 1.25 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.711 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.9 m -171.9 -38.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.521 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -64.97 -39.14 93.04 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.474 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -66.64 -35.6 80.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.786 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -80.13 88.0 5.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 15.7 tpt85 -174.0 -66.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.471 179.374 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -63.34 -41.29 98.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.524 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -75.99 -5.67 47.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.613 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -48.96 -69.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 -179.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.7 mt -65.4 -34.71 78.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.729 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.42 -44.68 72.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.6 m -63.73 -46.56 84.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.401 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.19 -43.45 95.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.771 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 81.2 mt -61.64 -43.6 98.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.79 0.329 . . . . 0.0 110.22 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -68.65 -46.42 69.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.288 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -62.02 -51.49 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.748 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.5 tp -63.7 -47.9 79.29 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.855 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.33 -28.54 66.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.898 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -55.41 -25.29 35.02 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.169 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -93.76 -92.26 0.18 Allowed 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.496 ' O ' ' CD2' ' A' ' 138' ' ' TYR . 83.6 t80 61.29 64.7 2.07 Favored Pre-proline 0 C--O 1.231 0.125 0 CA-C-O 120.948 0.404 . . . . 0.0 110.878 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.415 ' O ' ' O ' ' A' ' 140' ' ' ARG . 73.0 Cg_endo -84.49 -36.79 0.15 Allowed 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.101 1.867 . . . . 0.0 112.257 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.415 ' O ' ' O ' ' A' ' 139' ' ' PRO . 75.3 mtp180 -52.64 -171.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.562 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 54.81 33.51 19.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.798 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 36.2 ttm -125.57 -58.19 1.43 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.791 0.329 . . . . 0.0 110.601 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -66.32 -35.35 80.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.566 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 20.6 tptt -60.58 -34.06 73.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.146 0.498 . . . . 0.0 110.457 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -76.56 -35.92 57.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.529 178.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -68.54 -47.13 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.555 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 73.3 m -61.92 -42.63 99.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.116 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 48.5 tpp -54.76 -46.25 74.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.97 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 94.6 mt -70.06 -46.71 64.39 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.724 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 76.3 t -60.05 -44.75 95.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.542 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.2 tt -61.46 -44.82 96.42 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.042 0.449 . . . . 0.0 110.866 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.48 89.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 43.1 tp -58.46 -40.77 83.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.187 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.46 -43.87 96.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.251 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 96.7 mt -65.48 -46.57 79.24 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.318 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.24 -40.39 90.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.095 0.474 . . . . 0.0 110.194 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 161' ' ' SER . 19.3 tptm -64.49 -35.33 80.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.719 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.24 -40.31 95.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.322 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 57.8 t -75.85 -50.24 23.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.865 179.012 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.65 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -67.69 -50.1 59.38 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.814 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 161' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 160' ' ' ALA . 66.8 m 25.12 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.739 0.649 . . . . 0.0 111.487 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.65 ' N ' ' O ' ' A' ' 160' ' ' ALA . 90.0 m-70 -147.88 120.58 8.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.285 -177.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.37 175.57 2.65 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.319 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -57.23 -153.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.473 2.115 . . . . 0.0 111.753 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 3.4 m -152.82 -71.19 0.15 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.416 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 57.4 mt -64.34 -39.91 94.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.538 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.39 -37.52 87.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.405 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -59.74 -44.94 93.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.577 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -64.45 -44.12 92.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.95 0.405 . . . . 0.0 110.709 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 92.9 t -64.42 -44.16 97.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.786 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -59.92 -42.18 93.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.419 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.9 -49.3 78.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.493 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.8 m -59.41 -46.19 89.4 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.058 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.6 m -52.57 -44.99 66.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.825 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 75.0 t -58.93 -41.69 83.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.078 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 176' ' ' ASN . . . . . 0.403 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 55.5 t-20 -61.49 -39.5 91.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -59.01 -41.26 87.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.69 0.281 . . . . 0.0 110.676 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 36.0 mm -61.88 -40.91 88.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.236 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -64.59 -35.9 82.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.094 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -54.92 -102.42 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.844 0.354 . . . . 0.0 111.068 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 41.9 p-10 -80.88 72.32 7.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.775 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 63.1 tp -64.14 -42.76 96.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.723 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -60.51 -38.33 84.01 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.531 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 72.5 m -59.14 -44.95 92.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.229 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -61.84 -39.63 92.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.452 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.4 t -60.67 -48.72 87.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.513 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -63.82 -32.79 74.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.27 0.557 . . . . 0.0 110.687 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 16.3 m -57.34 -33.21 67.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.287 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.481 ' O ' ' HB3' ' A' ' 190' ' ' ALA . 4.1 mm? -87.45 -4.01 59.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.525 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 190' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 193' ' ' GLY . . . 67.11 41.4 2.62 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.486 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 79.2 ttt-85 -65.12 -38.99 92.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.338 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -59.34 -40.19 85.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.464 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 193' ' ' GLY . . . . . 0.482 ' O ' ' HB1' ' A' ' 190' ' ' ALA . . . -160.37 165.24 34.85 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 194' ' ' MET . . . . . 0.421 ' HG2' ' H ' ' A' ' 194' ' ' MET . 14.7 ptp -71.57 150.28 44.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.735 0.302 . . . . 0.0 110.373 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.567 -179.993 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -63.5 -41.88 98.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 110.621 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.439 ' C ' ' H ' ' A' ' 65' ' ' SER . 63.0 ttm-85 -65.48 -42.13 92.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.326 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.2 p -76.41 35.61 0.15 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.77 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.439 ' H ' ' C ' ' A' ' 63' ' ' ARG . 38.5 t -63.68 -16.78 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.538 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.0 m80 49.59 -111.16 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.491 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.9 t -158.67 151.97 22.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.587 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -80.55 136.85 36.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.359 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.2 mt -116.18 123.75 48.57 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.219 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -108.89 -159.2 19.23 Favored Glycine 0 N--CA 1.463 0.444 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -70.74 134.88 47.82 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.895 0.379 . . . . 0.0 110.573 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.448 ' CG1' ' N ' ' A' ' 73' ' ' GLU . 16.5 tt -134.79 166.08 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.602 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.448 ' N ' ' CG1' ' A' ' 72' ' ' ILE . 97.0 mt-10 -46.99 -45.62 21.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.49 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.63 ' O ' ' N ' ' A' ' 76' ' ' SER . . . -40.0 -75.79 0.03 OUTLIER 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.674 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 79' ' ' GLN . 67.6 t0 40.72 -83.12 0.0 OUTLIER 'General case' 0 CA--C 1.526 0.055 0 O-C-N 123.53 0.519 . . . . 0.0 111.069 179.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.63 ' N ' ' O ' ' A' ' 74' ' ' ALA . 48.1 t -57.13 -44.07 82.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.313 179.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -68.67 -34.32 75.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.345 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 p -118.55 43.8 2.42 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.321 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.52 ' N ' ' O ' ' A' ' 75' ' ' ASP . 56.3 tt0 -61.97 -43.24 99.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.489 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -67.33 -33.77 75.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.506 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -60.5 -37.38 80.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.603 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 93.6 mt -62.7 -44.36 99.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.38 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.6 mt -63.79 -44.7 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -55.59 -43.89 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.857 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.458 ' OD1' ' CD2' ' A' ' 89' ' ' HIS . 45.9 t-20 -63.97 -42.52 97.21 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.003 0.43 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.7 mt -60.3 -44.49 95.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.111 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.6 -50.34 73.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.963 0.411 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 94.1 mtm-85 -54.07 -45.95 71.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.458 ' CD2' ' OD1' ' A' ' 85' ' ' ASN . 36.1 m-70 -66.93 -41.82 86.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.075 0.464 . . . . 0.0 110.221 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.693 ' O ' HD23 ' A' ' 90' ' ' LEU . 3.2 tt -64.58 -41.7 96.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.099 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.17 82.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.396 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -65.24 -52.21 55.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.423 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.8 t -71.39 -26.4 26.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.045 0.45 . . . . 0.0 110.657 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -79.91 -40.73 13.73 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.45 -47.08 77.41 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.663 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.0 p -75.0 -31.24 61.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 54.92 -170.54 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.257 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.641 ' C ' ' H ' ' A' ' 100' ' ' SER . 51.7 t0 -86.35 2.25 48.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 60.66 -10.4 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.654 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.641 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.9 m -80.38 -17.58 51.47 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.952 0.406 . . . . 0.0 110.08 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 3.3 pt -45.84 142.04 3.92 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.861 -179.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -37.19 100.67 0.03 OUTLIER 'Trans proline' 0 C--N 1.317 -1.104 0 C-N-CA 122.685 2.257 . . . . 0.0 112.363 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -80.81 155.6 20.55 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 122.615 2.21 . . . . 0.0 112.173 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 96.73 -29.51 10.35 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.534 HD12 ' N ' ' A' ' 105' ' ' LEU . 10.3 mp -64.78 -35.21 80.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.874 0.368 . . . . 0.0 110.016 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 107' ' ' ASN . 12.6 p -50.48 -36.32 13.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.399 -178.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.432 ' N ' HG13 ' A' ' 106' ' ' VAL . 98.5 m-20 -61.25 -40.07 92.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.871 0.367 . . . . 0.0 110.159 179.774 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.05 -39.89 81.08 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 109' ' ' LEU . 9.6 mp -63.58 -42.78 98.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.519 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -39.02 86.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.9 -39.8 95.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.358 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -57.98 -47.74 82.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.761 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.79 -21.83 63.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.618 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -87.73 -55.49 3.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.587 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 32.8 m -67.07 89.77 0.18 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.722 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 35.1 p -152.16 16.19 0.64 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.651 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 120' ' ' GLU . 14.5 ptp180 -125.44 138.2 54.0 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.662 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.6 m -48.17 88.62 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.425 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.529 ' N ' ' O ' ' A' ' 118' ' ' ARG . 72.2 mm-40 -142.74 -63.13 0.42 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.785 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -71.06 69.65 0.5 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.183 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -173.88 -38.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.621 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -69.4 -39.68 77.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.132 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -67.6 -49.15 64.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.45 -179.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -77.07 -10.48 59.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.735 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -45.13 -85.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.743 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.6 mt -51.48 -35.76 41.37 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.98 70.15 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.225 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 99.7 m -63.29 -42.12 99.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.105 179.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.01 80.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.15 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.96 -42.37 93.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.825 0.345 . . . . 0.0 110.339 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -63.94 -49.96 70.54 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.232 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.82 -36.45 83.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.498 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.62 -55.04 39.4 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.445 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.27 -31.65 70.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.977 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -56.43 -26.95 55.27 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.112 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -159.65 57.09 0.38 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.275 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.503 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 22.2 p90 -83.22 122.44 77.41 Favored Pre-proline 0 CA--C 1.54 0.596 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.733 -179.578 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.443 ' O ' ' O ' ' A' ' 140' ' ' ARG . 63.8 Cg_endo -77.69 -78.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.462 0 C-N-CA 122.024 1.816 . . . . 0.0 112.39 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.508 ' O ' ' N ' ' A' ' 142' ' ' MET . 39.5 ttm180 58.57 145.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.381 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -45.6 91.72 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.401 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' MET . . . . . 0.508 ' N ' ' O ' ' A' ' 140' ' ' ARG . 47.9 ttp -128.79 -39.21 1.63 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.542 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -65.26 -44.6 87.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -61.57 -49.58 76.08 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.784 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.44 -35.24 65.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.757 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -69.17 -49.85 52.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.209 0.528 . . . . 0.0 110.884 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 54.4 m -71.0 -41.21 71.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.762 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 53.1 ttm -52.88 -46.17 67.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 75.8 mt -63.91 -49.77 71.36 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.292 179.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.24 -45.06 99.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.56 HD13 ' O ' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -61.99 -46.68 88.17 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.184 0.516 . . . . 0.0 110.321 -179.293 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -59.03 -41.27 87.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.146 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 49.1 tp -59.75 -41.66 91.47 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.334 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.58 -42.86 97.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.004 0.43 . . . . 0.0 110.223 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.73 -46.53 87.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.205 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.17 -37.21 78.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' LYS . . . . . 0.699 ' HZ1' HH12 ' A' ' 168' ' ' ARG . 88.6 tttt -62.29 -45.03 95.08 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.563 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -63.03 -38.09 89.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.5 t -66.33 -44.79 90.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.569 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.78 81.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.362 -179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 37.7 m -171.1 173.49 5.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.584 ' ND1' ' N ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER 179.25 69.08 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 84.7 m -116.87 81.7 12.37 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.42 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 164' ' ' PRO . . . . . 0.436 ' O ' ' CB ' ' A' ' 165' ' ' SER . 73.0 Cg_endo -82.04 -179.44 4.76 Favored 'Trans proline' 0 C--N 1.312 -1.361 0 C-N-CA 122.681 2.254 . . . . 0.0 111.872 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 0.7 OUTLIER 79.35 25.65 0.43 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 179.395 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 82.0 mt -143.98 -106.12 0.12 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.849 0.357 . . . . 0.0 110.569 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.696 HD23 ' N ' ' A' ' 167' ' ' LEU . 2.0 pt? -59.59 -26.24 65.26 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.317 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.699 HH12 ' HZ1' ' A' ' 157' ' ' LYS . 55.5 mtp85 -72.18 -40.85 67.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.893 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.03 -47.05 84.7 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.989 0.423 . . . . 0.0 111.275 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.435 HG13 ' N ' ' A' ' 171' ' ' PHE . 5.8 p -65.41 -41.36 90.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.235 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 171' ' ' PHE . . . . . 0.435 ' N ' HG13 ' A' ' 170' ' ' VAL . 76.7 t80 -61.59 -40.9 96.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.356 179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -58.21 -47.97 81.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.353 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.7 m -58.46 -42.5 87.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.896 0.379 . . . . 0.0 110.434 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 72.3 m -57.32 -42.71 82.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.081 0.467 . . . . 0.0 110.305 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.06 -40.95 84.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.359 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -60.56 -39.09 86.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.955 0.407 . . . . 0.0 110.384 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -60.75 -46.62 89.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.984 0.421 . . . . 0.0 110.506 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 178' ' ' ILE . . . . . 0.599 HG22 HD22 ' A' ' 182' ' ' LEU . 54.5 mt -69.59 -35.76 67.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.649 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -50.09 -34.44 21.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.618 -179.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -65.91 -36.25 82.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.795 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -121.01 38.47 4.05 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.883 0.373 . . . . 0.0 110.508 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.599 HD22 HG22 ' A' ' 178' ' ' ILE . 0.2 OUTLIER -61.64 -43.02 99.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.299 0.571 . . . . 0.0 110.2 -179.147 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.75 -47.28 80.42 Favored 'General case' 0 C--N 1.321 -0.63 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.137 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.4 m -59.2 -43.72 92.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.089 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.2 -38.97 84.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.56 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -59.75 -49.6 83.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.082 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 91.3 mtt-85 -68.46 -52.33 33.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 74.6 m -57.84 -37.04 73.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.115 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.531 ' C ' HD23 ' A' ' 189' ' ' LEU . 3.2 tt -101.46 107.69 19.07 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.085 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 190' ' ' ALA . . . . . 0.461 ' N ' HD23 ' A' ' 189' ' ' LEU . . . 58.22 117.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.381 179.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -72.21 131.47 42.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.38 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 63.0 t-20 -104.53 112.35 25.38 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.457 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -134.06 -106.6 0.93 Allowed Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 65.6 mtt 49.73 46.1 24.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.812 0.339 . . . . 0.0 110.516 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 68.2 t0 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.543 -179.976 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -63.41 -41.85 98.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.741 0.305 . . . . 0.0 110.452 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.401 ' HE ' ' CE ' ' A' ' 97' ' ' MET . 80.0 mtp85 -140.83 -49.89 0.44 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.449 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m -142.62 119.57 11.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.966 0.412 . . . . 0.0 110.381 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.6 m -160.58 165.16 31.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.375 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.431 ' O ' ' O ' ' A' ' 67' ' ' SER . 74.0 m80 -97.74 99.54 10.89 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.382 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.431 ' O ' ' O ' ' A' ' 66' ' ' HIS . 88.0 p 39.64 -162.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.815 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -158.56 109.65 2.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.233 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 69' ' ' LEU . 3.8 mm? -88.5 131.96 34.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.938 0.399 . . . . 0.0 110.679 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 167.07 51.32 0.03 OUTLIER Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.164 -0.775 . . . . 0.0 111.164 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.547 ' N ' ' CD ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -154.36 7.28 0.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.689 0.28 . . . . 0.0 110.759 -179.887 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.4 tt -78.97 32.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.284 0.564 . . . . 0.0 110.271 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.428 ' H ' ' C ' ' A' ' 71' ' ' ARG . 97.2 mt-10 56.56 33.66 23.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.582 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -137.71 -3.07 1.88 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 110.697 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -64.62 -33.46 75.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.699 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 78' ' ' SER . 86.7 p -59.59 163.35 4.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.651 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.471 ' C ' ' H ' ' A' ' 79' ' ' GLN . 79.9 tt0 58.66 -75.8 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.416 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 76' ' ' SER . 41.5 t -66.14 4.68 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.543 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLN . . . . . 0.471 ' H ' ' C ' ' A' ' 77' ' ' GLU . 58.8 tt0 -45.36 -36.39 4.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.99 -43.38 98.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.058 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.66 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.005 0.431 . . . . 0.0 110.315 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 86' ' ' ILE . 36.2 mm -63.2 -43.05 98.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.521 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.61 -43.75 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.107 0.479 . . . . 0.0 110.227 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.5 ttm-85 -70.58 -55.15 9.51 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.683 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -52.99 -50.52 64.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.088 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.508 HG23 ' N ' ' A' ' 87' ' ' ALA . 4.0 tp -65.12 -45.74 93.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.034 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.508 ' N ' HG23 ' A' ' 86' ' ' ILE . . . -62.63 -36.53 83.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.444 -179.453 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -59.94 -48.65 80.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.572 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -66.58 -40.04 88.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.204 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 93' ' ' VAL . 82.0 mt -67.52 -35.06 78.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.891 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.5 -48.27 75.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.239 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -65.87 -52.8 47.13 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.124 -0.63 . . . . 0.0 110.573 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 90' ' ' LEU . 3.4 p -66.29 -26.47 38.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.628 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.93 -27.3 29.17 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -73.58 -47.38 41.01 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.798 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.0 m -71.02 -5.04 28.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.862 0.363 . . . . 0.0 110.766 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.401 ' CE ' ' HE ' ' A' ' 63' ' ' ARG . 8.2 ttt -62.4 -38.53 90.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -65.43 -33.33 75.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.4 ttt85 -55.58 -44.61 77.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.487 -179.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.6 m -71.85 -23.43 61.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.167 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 49.0 mm -118.68 80.23 17.07 Favored Pre-proline 0 N--CA 1.47 0.564 0 CA-C-O 120.808 0.337 . . . . 0.0 110.685 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -48.51 147.49 9.16 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.671 2.247 . . . . 0.0 112.677 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -70.45 152.21 65.58 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.518 2.146 . . . . 0.0 112.381 179.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 83.39 -47.49 3.84 Favored Glycine 0 CA--C 1.524 0.617 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.792 179.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.532 HD12 ' N ' ' A' ' 105' ' ' LEU . 10.9 mp -63.64 -45.72 88.93 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.578 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.553 HG13 ' N ' ' A' ' 107' ' ' ASN . 7.3 p -68.44 -47.04 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.724 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.553 ' N ' HG13 ' A' ' 106' ' ' VAL . 91.5 m-20 -68.98 -35.73 77.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.717 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -57.84 -15.94 22.11 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.83 -47.9 78.96 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.824 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.6 -38.54 80.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.5 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.81 -39.36 94.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.824 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.89 -47.74 76.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.65 -179.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.483 ' C ' ' N ' ' A' ' 115' ' ' ASN . 4.0 mm? -68.56 -42.31 78.52 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.374 179.155 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -47.7 -14.59 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.075 0.464 . . . . 0.0 110.481 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.483 ' N ' ' C ' ' A' ' 113' ' ' LEU . 93.9 m-20 -61.17 -40.72 94.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.395 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 t -68.21 -38.87 82.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.13 0.491 . . . . 0.0 110.714 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 81.1 p -77.88 47.7 0.65 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.8 ptt85 -62.29 -35.99 80.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.524 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.2 p -76.27 -86.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.643 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -172.69 -51.75 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.547 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 57.83 24.63 11.04 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.837 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -101.12 9.3 42.17 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.797 0.332 . . . . 0.0 110.926 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 85.9 mtm-85 -65.29 -38.19 89.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.071 -179.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -62.85 -44.37 96.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.251 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.4 ptp180 -77.79 -7.64 56.88 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.02 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -43.03 -71.7 0.08 Allowed 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.626 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 58.0 mt -62.13 -35.76 79.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 120.639 0.256 . . . . 0.0 110.826 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -43.91 71.4 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.092 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.9 m -63.32 -47.66 81.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.239 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.58 -47.66 85.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.283 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.05 -40.44 97.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.446 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.47 -50.63 73.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.524 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -57.42 -44.7 84.87 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.702 -0.399 . . . . 0.0 109.962 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.91 -48.99 77.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.76 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.567 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.28 -42.2 86.04 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.94 -178.338 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -61.83 -28.22 69.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.98 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -135.16 94.1 3.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.902 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.468 ' O ' ' CD2' ' A' ' 138' ' ' TYR . 85.4 t80 -157.33 78.36 3.7 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.872 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -45.77 104.12 0.06 OUTLIER 'Trans proline' 0 C--N 1.307 -1.655 0 C-N-CA 122.445 2.097 . . . . 0.0 111.832 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 30.2 mmt180 -45.03 127.36 6.55 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.56 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -79.44 86.23 5.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.958 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 5.8 ptp -145.37 -46.66 0.22 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.031 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -64.02 -49.34 72.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.443 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -65.85 -40.76 92.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.67 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.81 -35.3 76.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.417 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 150' ' ' VAL . 38.1 ttmt -72.02 -35.82 69.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.912 0.387 . . . . 0.0 110.45 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 77.4 m -59.74 -44.06 93.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.025 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 51.0 mtt -61.04 -45.33 95.2 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.492 -0.483 . . . . 0.0 109.737 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.72 -43.14 94.38 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.702 179.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 146' ' ' LYS . 47.3 t -62.1 -43.25 97.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.528 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.28 -44.42 88.46 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.315 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.47 90.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.004 0.43 . . . . 0.0 110.493 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 18.9 tp -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.448 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -47.81 84.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.453 . . . . 0.0 110.253 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.0 tp -67.14 -45.27 77.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.272 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.22 87.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.618 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.0 -37.81 83.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.286 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -62.54 -43.08 99.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.125 0.488 . . . . 0.0 110.509 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.8 t -67.15 -43.83 88.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.335 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.69 -35.63 80.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.897 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 29.5 m -159.84 161.99 34.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.379 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -98.56 -26.19 14.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.736 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 4.3 p 64.04 145.19 0.08 OUTLIER Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.494 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -71.67 155.66 58.5 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.466 2.111 . . . . 0.0 111.943 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' SER . . . . . 0.46 ' O ' ' N ' ' A' ' 167' ' ' LEU . 8.7 t -93.13 -153.58 0.36 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 7.9 tp 66.77 -60.92 0.33 Allowed 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.58 0.55 . . . . 0.0 110.699 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' A' ' 165' ' ' SER . 53.7 mt -63.28 -33.38 75.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.274 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -64.4 -45.83 85.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.553 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -66.12 -43.67 86.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.478 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 82.8 t -63.93 -44.94 98.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.348 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -61.0 -41.34 96.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.45 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -63.45 -49.68 72.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.815 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 16.4 m -61.74 -42.6 99.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.806 0.336 . . . . 0.0 110.432 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.7 m -53.87 -44.09 70.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.585 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.4 t -64.29 -42.12 94.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.807 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -72.09 -38.6 69.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.267 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -60.85 -43.02 98.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.796 -179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 95.1 mt -62.32 -39.88 85.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.105 0.479 . . . . 0.0 109.914 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 180' ' ' GLN . 61.8 t30 -48.87 -34.15 12.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.816 -179.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 180' ' ' GLN . . . . . 0.486 ' O ' ' O ' ' A' ' 179' ' ' ASN . 81.7 mm-40 -32.3 -99.33 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 O-C-N 124.043 0.839 . . . . 0.0 110.652 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -128.95 -14.25 4.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.335 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.431 ' O ' HG12 ' A' ' 186' ' ' VAL . 55.5 mt -58.87 -35.24 72.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.827 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 183' ' ' ARG . . . . . 0.466 ' CZ ' ' OD1' ' A' ' 179' ' ' ASN . 44.1 ttm180 -51.0 -42.15 60.17 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.154 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 85.5 m -72.36 -51.49 20.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.793 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -63.68 -49.35 73.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.385 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 186' ' ' VAL . . . . . 0.431 HG12 ' O ' ' A' ' 182' ' ' LEU . 3.0 p -58.41 -35.01 52.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.148 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 59.5 ttt85 -59.68 -52.28 66.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.903 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 78.2 p -58.73 -48.71 80.22 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.694 -179.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.81 -40.42 95.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.525 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -75.28 67.1 1.84 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.513 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -93.44 3.0 56.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.826 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 45.7 p-10 -86.08 161.36 18.96 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.381 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -159.57 110.33 0.44 Allowed Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 194' ' ' MET . . . . . 0.458 ' SD ' ' O ' ' A' ' 194' ' ' MET . 0.0 OUTLIER -84.82 143.44 29.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.67 0.271 . . . . 0.0 110.507 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.614 179.915 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.37 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -64.46 -41.19 96.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.798 0.332 . . . . 0.0 110.712 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -72.48 142.69 48.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.317 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 t -61.26 -42.97 99.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.499 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.3 m 61.01 85.08 0.12 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.507 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -82.36 -11.8 58.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.493 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 82.5 p 51.26 -153.87 0.17 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.377 -179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.472 ' O ' ' O ' ' A' ' 69' ' ' LEU . 62.4 ttp180 -138.59 -62.59 0.56 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.559 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.543 HD12 ' N ' ' A' ' 69' ' ' LEU . 10.3 mp 54.65 115.43 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.1 0.476 . . . . 0.0 110.522 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.447 ' O ' ' O ' ' A' ' 71' ' ' ARG . . . -75.68 29.33 1.27 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.039 -0.825 . . . . 0.0 111.039 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.469 ' H ' ' C ' ' A' ' 69' ' ' LEU . 16.5 mmm180 55.06 112.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.963 0.411 . . . . 0.0 110.523 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.0 pt -128.79 164.56 30.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.705 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 56.12 31.51 18.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.62 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -157.73 -14.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.493 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 40.1 p30 -75.08 -8.01 55.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.489 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 41.4 t -77.26 138.95 39.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.534 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 45.0 27.23 0.26 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.437 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.6 t -162.99 39.63 0.1 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.503 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -65.06 -30.49 71.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.772 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -38.84 82.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.538 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -63.05 -42.36 99.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.464 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.59 -44.78 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.415 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.4 mt -63.22 -43.66 98.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.92 0.391 . . . . 0.0 110.179 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.414 ' HG2' ' HE ' ' A' ' 88' ' ' ARG . 44.8 ttm180 -52.58 -54.42 33.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.825 -179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.526 ' ND2' ' NE2' ' A' ' 89' ' ' HIS . 14.9 t-20 -57.51 -40.94 79.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 110.672 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.4 mt -60.24 -52.87 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.277 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.54 72.69 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.117 0.484 . . . . 0.0 110.478 -179.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.414 ' HE ' ' HG2' ' A' ' 84' ' ' ARG . 93.9 mtt-85 -61.08 -44.38 97.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.474 179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.526 ' NE2' ' ND2' ' A' ' 85' ' ' ASN . 77.7 m-70 -66.38 -44.03 84.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.934 0.397 . . . . 0.0 110.648 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.3 mp -69.23 -35.09 75.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.572 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.52 -47.96 83.51 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.596 -179.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -67.79 -52.44 37.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.344 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.4 t -66.86 -27.22 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.561 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -65.83 -39.55 95.15 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.42 -44.89 95.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.893 0.377 . . . . 0.0 110.632 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.455 ' C ' ' N ' ' A' ' 98' ' ' ASP . 68.9 m -77.32 -3.44 39.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.73 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.4 ttm -49.79 -13.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.455 ' N ' ' C ' ' A' ' 96' ' ' SER . 88.9 m-20 -66.18 -11.25 48.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.505 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -73.51 -66.04 0.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.612 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.451 ' O ' ' C ' ' A' ' 101' ' ' ILE . 72.1 m -77.29 -70.87 0.44 Allowed 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.47 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.451 ' C ' ' O ' ' A' ' 100' ' ' SER . 1.4 tt 31.01 73.63 0.48 Allowed Pre-proline 0 C--O 1.223 -0.305 0 O-C-N 123.635 0.584 . . . . 0.0 110.97 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -76.88 112.73 3.49 Favored 'Trans proline' 0 C--N 1.298 -2.128 0 C-N-CA 121.973 1.782 . . . . 0.0 111.898 -178.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.499 ' O ' ' N ' ' A' ' 105' ' ' LEU . 72.1 Cg_endo -78.68 -8.44 15.84 Favored 'Trans proline' 0 C--N 1.314 -1.281 0 C-N-CA 122.547 2.165 . . . . 0.0 112.165 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.469 ' C ' ' O ' ' A' ' 103' ' ' PRO . . . -32.29 -35.55 0.02 OUTLIER Glycine 0 N--CA 1.466 0.658 0 N-CA-C 111.395 -0.682 . . . . 0.0 111.395 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' A' ' 103' ' ' PRO . 0.4 OUTLIER -83.95 40.35 0.75 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.179 0.514 . . . . 0.0 110.442 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.449 ' N ' ' O ' ' A' ' 103' ' ' PRO . 0.0 OUTLIER -70.34 -44.57 77.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.024 179.157 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 56.5 t-20 -57.01 -50.0 74.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.348 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -70.42 -46.56 48.01 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.427 ' O ' ' N ' ' A' ' 113' ' ' LEU . 47.2 tp -52.18 -47.75 65.37 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.929 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.32 74.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.275 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.414 ' O ' ' N ' ' A' ' 115' ' ' ASN . 82.4 mt -67.48 -46.88 71.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.005 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -64.4 -33.39 75.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.228 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 109' ' ' LEU . 53.6 tp -66.54 -39.26 88.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.945 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -91.17 -21.89 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.884 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASN . . . . . 0.426 ' HB3' ' HE ' ' A' ' 118' ' ' ARG . 96.7 m-20 -88.67 4.0 48.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 54.0 m -72.43 -38.22 68.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.988 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 36.1 t -58.54 -43.48 89.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.043 -178.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.426 ' HE ' ' HB3' ' A' ' 115' ' ' ASN . 39.5 ptt180 -80.24 -21.85 42.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.046 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.418 ' O ' ' N ' ' A' ' 121' ' ' GLU . 82.4 p -67.64 -147.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.15 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 67.72 -59.63 0.41 Allowed 'General case' 0 C--N 1.332 -0.161 0 O-C-N 123.616 0.572 . . . . 0.0 110.45 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 119' ' ' SER . 17.0 pt-20 -88.51 -12.31 43.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.666 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -73.37 -13.01 61.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.729 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -67.98 -38.13 82.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.701 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.42 ' O ' ' N ' ' A' ' 126' ' ' ASP . 97.4 m-20 -62.85 -37.52 87.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.445 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.403 ' O ' ' OG1' ' A' ' 129' ' ' THR . 38.4 mmt-85 -68.93 53.69 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.519 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 124' ' ' ASN . 38.2 t70 -115.71 -70.9 0.77 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.535 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.5 mt -67.48 -43.56 80.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.804 0.335 . . . . 0.0 110.93 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.02 -32.78 74.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.436 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 125' ' ' ARG . 21.4 m -62.33 -52.66 62.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.324 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.53 88.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.33 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.7 tp -62.0 -48.69 79.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.25 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -59.33 -35.02 73.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.239 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -63.63 -40.48 97.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.594 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.0 tp -62.13 -44.34 96.85 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.619 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 135' ' ' LEU . 9.7 mp -74.83 -32.41 61.93 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.658 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -56.95 -41.16 77.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -122.31 72.55 1.06 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.703 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.449 ' O ' ' CG ' ' A' ' 138' ' ' TYR . 69.0 t80 -174.6 59.0 0.21 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.601 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -76.34 110.87 3.15 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.588 2.192 . . . . 0.0 111.741 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 61.7 ttt85 -149.22 143.98 26.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.453 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.94 110.16 3.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 74.6 mtm -101.23 -40.22 7.26 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.566 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.517 ' OE1' ' N ' ' A' ' 144' ' ' LYS . 7.1 tm-20 -70.71 -47.0 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' LYS . . . . . 0.517 ' N ' ' OE1' ' A' ' 143' ' ' GLU . 10.4 tptm -62.71 -48.42 79.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.841 -179.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.54 -50.78 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.355 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' LYS . . . . . 0.416 ' O ' HG23 ' A' ' 150' ' ' VAL . 55.3 mtpt -63.48 -39.06 93.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.533 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 74.9 m -59.89 -46.86 88.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.567 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.6 mtm -64.58 -41.9 95.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.585 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 78.0 mt -63.69 -44.26 94.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.968 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 146' ' ' LYS . 72.4 t -66.93 -43.14 89.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.432 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 55.4 tp -59.11 -46.6 87.89 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.474 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.6 -38.81 90.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.263 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.7 tp -63.68 -41.26 98.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.463 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 64.8 mt -60.22 -43.09 96.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.208 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.35 -41.84 98.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.242 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.87 -33.45 70.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.256 0.551 . . . . 0.0 110.502 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -72.46 -44.2 62.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.343 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.06 -48.2 77.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.489 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 160' ' ' ALA . 14.9 p -62.18 -36.84 76.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.249 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -60.97 -51.35 69.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.625 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 161' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 23.7 p -24.14 141.47 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.793 0.683 . . . . 0.0 110.684 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.57 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.5 m-70 168.51 -38.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.36 156.68 75.97 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.384 -179.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.98 144.61 88.29 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.61 2.206 . . . . 0.0 111.713 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 85.0 p -91.74 -8.52 46.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 65.6 mt -61.0 -55.51 32.07 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.45 -179.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 54.3 tp -61.54 -42.28 98.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.235 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -65.39 -39.42 92.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.628 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 169' ' ' ASP . . . . . 0.449 ' O ' HG23 ' A' ' 173' ' ' THR . 99.7 m-20 -62.88 -46.63 86.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.997 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.477 ' O ' ' OG1' ' A' ' 173' ' ' THR . 77.1 t -64.3 -44.28 97.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.228 0.537 . . . . 0.0 110.17 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -57.62 -45.56 85.23 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.238 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -65.51 -41.88 92.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.86 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 18.6 p -58.82 -46.59 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.325 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.42 -43.96 88.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.029 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.9 t -59.71 -43.4 91.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.193 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -60.94 -39.73 90.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.655 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -60.91 -46.66 89.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.821 0.343 . . . . 0.0 110.483 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.99 -41.55 92.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.36 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.428 ' O ' ' CB ' ' A' ' 183' ' ' ARG . 12.8 m120 -49.13 -34.42 14.08 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.354 -179.114 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -43.48 -30.59 0.58 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.124 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -107.87 -50.34 3.07 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.885 0.374 . . . . 0.0 110.914 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.524 HD22 ' N ' ' A' ' 182' ' ' LEU . 4.1 mm? -60.68 -37.01 80.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.553 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 183' ' ' ARG . . . . . 0.583 HH12 ' NH1' ' A' ' 187' ' ' ARG . 73.8 ttt-85 -53.82 -41.37 67.27 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.379 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -60.29 -51.98 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.644 -179.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -67.92 -39.57 83.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.745 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.08 -42.47 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.705 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 187' ' ' ARG . . . . . 0.583 ' NH1' HH12 ' A' ' 183' ' ' ARG . 62.3 ttp180 -60.28 -45.23 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.773 -179.078 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 36.2 t -58.89 -51.22 70.96 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.762 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 189' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 189' ' ' LEU . 4.0 mm? -65.95 -40.39 91.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.674 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -171.42 -113.43 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.393 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -174.09 -54.04 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.713 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -81.25 142.97 32.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.556 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -143.98 17.33 2.16 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 87.2 mtp -83.1 139.75 33.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.824 0.345 . . . . 0.0 110.543 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 65.6 t0 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.58 -179.941 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.456 -0.128 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -58.88 -30.97 68.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.341 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.82 -35.15 79.68 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.195 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -62.78 -34.42 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.2 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.47 -43.76 98.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.349 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.87 -44.12 98.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -58.06 -44.51 87.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.112 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.96 -44.49 92.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 0.0 109.98 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.2 mt -61.58 -42.31 93.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.569 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.84 -51.49 68.79 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -52.31 -44.12 64.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.327 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -60.61 -50.75 72.25 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.99 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.549 ' O ' ' N ' ' A' ' 94' ' ' GLY . 11.7 mt -57.81 -38.32 75.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.974 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.81 74.13 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -57.52 -50.95 71.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.198 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.2 t -71.42 -26.23 26.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 121.229 0.538 . . . . 0.0 110.483 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.14 -28.57 68.06 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.216 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 98' ' ' ASP . 92.6 m-20 -68.79 -37.86 79.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.746 0.308 . . . . 0.0 111.139 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.1 t -71.25 -12.76 61.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.513 -179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 89.8 mmm -71.46 -10.42 59.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.732 0.301 . . . . 0.0 110.974 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' A' ' 95' ' ' ASP . 42.1 p-10 -98.59 8.52 44.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.731 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -155.79 38.44 0.37 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.918 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 56.7 p . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 120.869 0.366 . . . . 0.0 110.431 -179.974 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.731 ' N ' HD12 ' A' ' 105' ' ' LEU . 6.3 mp . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.729 0.3 . . . . 0.0 111.046 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 7.2 p -60.17 -33.74 54.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.607 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.6 t-20 -69.15 -50.14 50.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.107 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.89 -48.89 18.27 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.23 -44.15 96.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.808 0.337 . . . . 0.0 110.262 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.553 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.5 tp -66.27 -44.69 82.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.99 0.424 . . . . 0.0 110.55 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -67.62 -35.04 78.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.467 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.1 tp -60.78 -42.69 98.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.59 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -65.88 -39.29 90.54 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.746 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -62.83 -44.68 95.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.582 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 97.3 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.023 179.9 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.528 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 21.3 p-10 . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.417 0.151 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 54.9 mt -62.61 -35.73 80.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.545 0.212 . . . . 0.0 111.009 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.82 -41.36 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.324 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.5 m -61.77 -44.47 96.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.03 0.443 . . . . 0.0 110.15 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -46.58 80.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.6 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.88 -42.81 99.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.96 -52.84 37.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -59.63 -47.88 83.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.364 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.16 -48.8 76.91 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.268 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.24 -42.62 99.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 -179.663 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 70.0 mtp . . . . . 0 N--CA 1.467 0.386 0 CA-C-O 120.426 0.155 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.416 ' O ' ' CB ' ' A' ' 147' ' ' THR . 11.1 mt-10 -65.66 -43.79 88.29 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-O 120.876 0.37 . . . . 0.0 110.485 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -63.67 -31.03 72.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.776 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -75.86 -50.67 14.42 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.221 0.534 . . . . 0.0 110.924 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -68.25 -42.07 80.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.603 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.416 ' CB ' ' O ' ' A' ' 143' ' ' GLU . 99.6 m -62.15 -42.51 99.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.389 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 42.0 ttm -59.27 -46.33 88.81 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.65 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.3 -50.31 54.45 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.945 -0.702 . . . . 0.0 110.409 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -42.92 95.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.298 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.405 ' CB ' ' O ' ' A' ' 147' ' ' THR . 48.4 tp -60.93 -43.84 98.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.307 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.76 98.22 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.156 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 51.9 tp -60.62 -41.86 95.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.8 -41.76 96.28 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.103 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.416 ' O ' HG23 ' A' ' 159' ' ' VAL . 56.2 tp -62.33 -47.12 85.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.955 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.52 79.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -61.42 -45.83 92.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.384 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.86 -38.99 93.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.51 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 155' ' ' LEU . 83.4 t -66.58 -44.46 89.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.316 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.33 -39.52 92.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.187 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 64.0 m -164.55 167.16 19.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.162 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . 0.445 ' O ' ' C ' ' A' ' 163' ' ' THR . 33.2 m170 -112.63 115.55 28.76 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.445 ' C ' ' O ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER -29.39 93.55 0.05 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.442 0.464 . . . . 0.0 111.207 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 162' ' ' HIS . 32.5 Cg_exo -55.16 143.69 73.47 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 121.875 1.716 . . . . 0.0 112.291 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . 0.445 ' O ' ' N ' ' A' ' 167' ' ' LEU . 11.0 p . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.828 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 165' ' ' SER . 50.2 mt . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 120.901 0.382 . . . . 0.0 110.356 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -64.35 -47.09 80.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.9 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.23 -46.74 85.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.393 . . . . 0.0 110.677 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.1 -44.84 97.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.322 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.45 -43.12 97.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -57.34 -48.89 77.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.721 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 17.7 m -59.9 -47.09 87.17 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.5 m -53.48 -43.06 67.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.117 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.4 t -61.48 -40.86 87.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.326 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 . . . . . 0 CA--C 1.53 0.176 0 CA-C-O 120.856 0.36 . . . . 0.0 110.417 -179.652 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 74.5 mt . . . . . 0 N--CA 1.462 0.149 0 CA-C-O 120.835 0.35 . . . . 0.0 110.646 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . 0.431 ' O ' ' CB ' ' A' ' 187' ' ' ARG . 39.2 mmt-85 -54.37 -31.33 54.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.539 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.6 m -58.15 -47.92 81.84 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.555 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -73.42 -48.1 36.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.003 0.43 . . . . 0.0 111.001 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 86.0 t -62.17 -44.6 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.772 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . 0.431 ' CB ' ' O ' ' A' ' 183' ' ' ARG . 77.9 ttt-85 -62.22 -44.02 97.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.482 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 68.7 m -60.34 -40.76 91.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.886 0.374 . . . . 0.0 110.316 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 53.7 tp . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 -179.844 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.573 0.225 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 68.22 -60.16 0.42 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.612 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.433 ' HB3' HH12 ' A' ' 84' ' ' ARG . 14.6 mm-40 -61.24 -33.75 74.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.378 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -58.4 -28.56 65.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.205 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.7 mt -60.91 -47.33 93.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.231 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.35 -45.1 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.433 HH12 ' HB3' ' A' ' 80' ' ' GLU . 84.1 mtt85 -55.82 -44.47 77.92 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.975 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -63.7 -45.09 91.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.017 0.437 . . . . 0.0 110.41 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.6 mt -58.17 -44.58 87.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.105 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.75 93.85 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.425 -0.51 . . . . 0.0 109.813 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -52.6 -45.56 66.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.047 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -46.59 89.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.155 0.502 . . . . 0.0 110.307 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.0 mp -62.22 -39.57 93.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.074 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.08 -41.32 78.6 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.017 0.437 . . . . 0.0 110.229 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -63.19 -51.9 64.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.111 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.91 -26.36 30.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.245 0.545 . . . . 0.0 110.342 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -73.64 -41.63 42.66 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -63.95 -42.97 97.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.775 0.322 . . . . 0.0 110.632 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 98' ' ' ASP . 51.1 m -57.09 -39.48 75.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.427 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.04 60.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.293 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 98' ' ' ASP . 67.6 t0 -169.72 42.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.418 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -131.84 -38.38 1.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.467 0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.857 179.852 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 105' ' ' LEU . 10.9 mp . . . . . 0 CA--C 1.528 0.113 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 85.6 t -64.32 -46.15 93.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.974 0.416 . . . . 0.0 110.732 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -63.38 -50.34 70.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.883 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -60.71 -32.95 80.62 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.2 tp -61.54 -46.41 90.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -54.96 -48.93 72.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.117 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.427 HD12 ' N ' ' A' ' 111' ' ' LEU . 11.2 mp -65.84 -39.2 90.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.488 178.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.34 -45.26 91.86 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.124 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.4 tp -63.65 -42.59 98.09 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.699 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 116' ' ' THR . 59.2 ttm-85 -75.2 -42.89 54.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.009 0.433 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -44.92 -17.55 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.171 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.479 ' N ' ' O ' ' A' ' 114' ' ' ARG . 16.4 m . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 66.6 t0 . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.1 mt -50.32 -38.19 40.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.451 -178.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.81 -48.95 69.36 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.26 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.3 m -60.94 -42.78 98.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.574 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.52 -47.94 78.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.346 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.91 -41.59 87.62 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.459 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -55.44 -51.41 67.01 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.941 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -53.99 -47.73 71.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.678 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.21 -43.53 94.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.442 . . . . 0.0 109.966 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.55 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -56.4 -46.88 79.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.498 -178.079 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 . . . . . 0 C--N 1.324 -0.505 0 C-N-CA 120.569 -0.452 . . . . 0.0 109.96 -179.996 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.6 ttp . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.816 0.341 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -65.33 -35.12 80.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 26.9 tptt -61.53 -47.64 84.66 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.837 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.498 ' O ' HD13 ' A' ' 149' ' ' LEU . 80.5 mm-40 -64.01 -41.75 97.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.825 0.345 . . . . 0.0 110.569 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.526 ' O ' HG23 ' A' ' 150' ' ' VAL . 31.2 ttpt -58.29 -42.24 86.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.45 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.1 m -60.19 -46.84 88.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.709 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.2 mtm -64.59 -41.53 96.19 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.749 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 145' ' ' GLU . 7.7 mp -63.99 -41.1 97.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.727 0.299 . . . . 0.0 110.626 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 146' ' ' LYS . 53.8 t -60.83 -45.06 98.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.476 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.2 tp -61.39 -45.41 94.49 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.463 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.94 -37.0 86.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.639 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.87 -41.92 99.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.417 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.02 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.18 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.42 ' O ' HG23 ' A' ' 159' ' ' VAL . 91.4 mt -61.39 -43.31 99.08 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.023 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -71.65 -46.62 58.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.47 179.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.97 -37.46 87.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.507 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -61.07 -44.55 97.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.596 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 155' ' ' LEU . 53.1 t -60.17 -48.81 86.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.323 -179.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.14 -38.54 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.952 0.406 . . . . 0.0 110.955 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . 0.564 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 29.4 t -72.04 -165.57 0.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.416 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . 0.564 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.9 m-70 167.38 89.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.119 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.1 p -123.74 152.98 66.64 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.584 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -68.03 156.36 66.14 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.489 2.126 . . . . 0.0 111.7 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 83.8 p . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.624 -179.953 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.539 HD22 ' N ' ' A' ' 167' ' ' LEU . 3.9 mm? . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.892 0.377 . . . . 0.0 110.519 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -61.87 -38.02 86.72 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.42 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -62.72 -46.89 85.99 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.557 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.0 t -66.63 -48.92 78.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.049 0.452 . . . . 0.0 110.143 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -56.23 -39.46 72.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.628 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -61.56 -41.37 97.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.687 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 99.3 m -59.54 -46.59 88.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.551 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 81.7 m -57.88 -43.71 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.029 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.9 t -56.67 -43.79 79.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.721 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.771 179.703 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.41 HD12 ' N ' ' A' ' 182' ' ' LEU . 11.1 mp . . . . . 0 C--O 1.221 -0.403 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 187' ' ' ARG . 61.0 ttt85 -51.51 -43.28 62.2 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.498 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -63.44 -52.3 62.04 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.749 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -68.5 -41.0 80.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.833 0.349 . . . . 0.0 111.282 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 189' ' ' LEU . 40.7 t -62.76 -45.77 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.552 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 183' ' ' ARG . 64.5 ttm-85 -60.56 -52.54 64.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.42 -178.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 79.8 p -63.72 -38.95 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.726 0.298 . . . . 0.0 110.616 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.443 ' O ' ' O ' ' A' ' 186' ' ' VAL . 54.7 tp . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.308 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.0 p . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.817 0.342 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.38 -9.47 56.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.18 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -71.34 -37.0 71.74 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.434 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.35 -51.48 69.32 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.281 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.406 HG23 ' N ' ' A' ' 83' ' ' ILE . 12.9 tt -65.18 -41.3 91.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.094 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.406 ' N ' HG23 ' A' ' 82' ' ' ILE . 73.6 mt -63.09 -42.35 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.171 178.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -55.72 -48.77 74.6 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.623 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -60.84 -41.79 96.53 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.515 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.01 -44.63 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.897 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.85 -46.28 78.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.803 0.335 . . . . 0.0 110.35 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 95.2 mtm-85 -56.25 -43.52 78.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.649 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -64.12 -45.54 88.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.085 0.469 . . . . 0.0 110.475 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.05 -35.69 80.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.204 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.51 82.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.712 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.95 -52.52 55.84 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.529 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.73 -25.93 31.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.758 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.546 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -84.44 -35.34 14.42 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.318 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -65.15 -47.15 78.07 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.537 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 29.8 t -166.0 152.63 9.54 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.725 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.7 tpt -154.93 128.72 8.67 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.144 0.497 . . . . 0.0 110.602 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.563 ' O ' ' N ' ' A' ' 100' ' ' SER . 89.7 m-20 40.09 65.04 0.79 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.226 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -38.02 -24.07 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.188 0.518 . . . . 0.0 110.598 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 98' ' ' ASP . 26.8 t . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.628 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.443 ' N ' ' CD2' ' A' ' 105' ' ' LEU . 4.0 mm? . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.56 0.219 . . . . 0.0 110.63 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 107' ' ' ASN . 12.7 p -61.17 -43.77 97.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.643 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.56 ' N ' HG13 ' A' ' 106' ' ' VAL . 50.2 t-20 -65.84 -36.4 83.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.0 110.489 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.99 -26.04 4.18 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.516 ' N ' HD22 ' A' ' 109' ' ' LEU . 4.0 mm? -62.66 -43.48 98.69 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.022 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.06 -40.09 69.95 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.893 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 50.6 tp -66.69 -41.47 88.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.708 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -54.68 -42.78 71.83 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.31 -40.44 97.34 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.435 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -74.06 -28.12 61.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.421 . . . . 0.0 110.596 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -63.57 -41.88 98.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.696 -179.848 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 25.6 p-10 . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 111.331 0.123 . . . . 0.0 111.331 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.544 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 51.9 mt -67.1 -34.24 77.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 110.812 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -39.39 66.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.1 m -62.03 -47.35 85.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.433 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.72 -43.59 94.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.946 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.28 -41.7 98.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 110.476 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -60.31 -46.58 89.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.358 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.46 -52.65 63.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.65 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.24 -49.49 73.94 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.157 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 56.7 tp -57.19 -38.08 73.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.274 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 . . . . . 0 C--N 1.323 -0.577 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.261 179.797 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 38.8 ttm . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.837 0.351 . . . . 0.0 110.452 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.407 ' O ' ' OG1' ' A' ' 147' ' ' THR . 43.5 tp10 -67.16 -35.07 78.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.73 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.58 -31.58 69.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.725 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -69.05 -47.95 64.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.148 0.499 . . . . 0.0 110.815 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.419 ' O ' HG23 ' A' ' 150' ' ' VAL . 53.8 mtmt -67.24 -38.13 84.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.721 178.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 10.2 m -58.55 -43.27 89.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.113 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.5 mtt -61.41 -46.4 90.29 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.04 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.6 mp -65.71 -45.85 81.21 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 119.622 -0.831 . . . . 0.0 110.466 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 146' ' ' LYS . 64.9 t -60.53 -42.54 91.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 -179.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 27.1 mt -60.01 -42.59 94.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.036 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.73 -43.74 95.62 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.174 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.567 HD11 ' NZ ' ' A' ' 157' ' ' LYS . 38.0 tp -60.72 -42.31 97.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.0 mt -61.25 -43.43 98.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.049 0.452 . . . . 0.0 110.158 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.422 ' O ' HG23 ' A' ' 159' ' ' VAL . 88.9 mt -63.41 -44.09 95.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.054 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.23 -35.46 76.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . 0.567 ' NZ ' HD11 ' A' ' 153' ' ' LEU . 26.8 mmtm -60.27 -48.99 79.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.044 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -67.31 -40.75 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.022 0.439 . . . . 0.0 110.897 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 155' ' ' LEU . 71.1 t -67.71 -44.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.535 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.75 96.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . 0.421 ' O ' ' O ' ' A' ' 157' ' ' LYS . 25.8 t -173.51 179.2 2.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.351 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -128.42 143.94 51.07 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.063 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.4 p -78.36 150.05 76.37 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.607 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.48 156.34 61.67 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.26 1.974 . . . . 0.0 112.012 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 72.3 m . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.381 179.596 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.549 HD12 ' N ' ' A' ' 167' ' ' LEU . 9.0 mp . . . . . 0 C--O 1.231 0.11 0 CA-C-O 121.022 0.439 . . . . 0.0 110.088 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.45 -42.64 99.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.14 -45.79 86.96 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.996 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.69 -44.53 96.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.467 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.88 -41.9 92.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.284 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.96 -48.71 80.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.612 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.8 m -59.3 -46.73 87.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.078 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.6 m -52.94 -43.11 66.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.986 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.4 t -61.04 -44.98 99.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.366 179.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 . . . . . 0 C--N 1.331 -0.236 0 CA-C-O 121.024 0.44 . . . . 0.0 110.464 179.295 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 N--CA 1.462 0.137 0 CA-C-O 120.816 0.341 . . . . 0.0 110.715 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . 0.421 ' HD3' ' H ' ' A' ' 183' ' ' ARG . 0.7 OUTLIER -61.47 -45.65 93.37 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 18.9 m -58.0 -46.64 84.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.855 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -54.19 -41.97 69.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.61 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 70.9 t -60.3 -50.83 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.284 -0.567 . . . . 0.0 110.246 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -67.85 -33.83 75.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.274 0.559 . . . . 0.0 110.475 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 35.2 t -58.04 -44.08 87.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.172 -179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 80' ' ' GLU . 60.5 m . . . . . 0 CA--C 1.52 -0.183 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 68.0 -38.43 0.36 Allowed 'General case' 0 CA--C 1.528 0.115 0 O-C-N 123.495 0.497 . . . . 0.0 110.738 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.52 ' H ' ' C ' ' A' ' 78' ' ' SER . 16.5 mm-40 -64.81 -33.74 76.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.276 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -58.22 -30.79 66.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.342 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.13 -45.95 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.874 0.369 . . . . 0.0 110.187 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.12 -42.1 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.507 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -56.49 -44.57 80.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.478 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -64.67 -41.53 96.02 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 110.528 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 80.4 mt -60.14 -41.73 87.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.208 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.141 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 75.8 mtp85 -54.63 -45.74 73.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.431 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -63.69 -49.93 71.2 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.387 0.613 . . . . 0.0 110.232 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.1 -32.56 73.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.903 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -65.58 -36.33 83.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.264 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -63.56 -52.04 62.79 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.229 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.02 -26.37 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.415 0.626 . . . . 0.0 110.715 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.21 -38.56 10.95 Favored Glycine 0 N--CA 1.466 0.644 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.66 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.6 t70 -78.75 -44.07 24.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.415 0.15 . . . . 0.0 111.045 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 5.0 m -77.02 121.47 23.56 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.086 0.469 . . . . 0.0 110.809 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 94.0 mmm -140.38 19.45 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -63.23 -38.92 93.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.725 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -61.51 -40.41 94.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.651 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 CA--C 1.516 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 -179.951 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 105' ' ' LEU . 10.8 mp . . . . . 0 C--O 1.226 -0.176 0 CA-C-O 120.745 0.307 . . . . 0.0 110.728 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.505 HG13 ' N ' ' A' ' 107' ' ' ASN . 9.9 p -55.51 -43.34 72.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.98 0.419 . . . . 0.0 110.525 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.505 ' N ' HG13 ' A' ' 106' ' ' VAL . 65.8 t30 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.633 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -60.34 -34.81 86.48 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 17.2 mt -61.55 -42.3 98.63 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.481 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.51 -39.16 70.14 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.371 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.2 mt -67.78 -38.19 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.848 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -59.12 -40.6 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.151 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.554 ' O ' HG22 ' A' ' 116' ' ' THR . 4.2 mm? -63.13 -42.56 99.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.923 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 67.7 ttt-85 -78.43 -42.1 31.04 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.038 0.447 . . . . 0.0 110.677 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -48.78 -31.78 7.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.833 -178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.554 HG22 ' O ' ' A' ' 113' ' ' LEU . 1.4 t . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.585 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 42.8 t0 . . . . . 0 N--CA 1.449 -0.494 0 CA-C-O 120.367 0.127 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 51.5 mt -66.75 -34.99 79.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.835 0.35 . . . . 0.0 111.019 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -36.12 63.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.797 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 72.4 m -61.23 -46.76 89.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.446 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.53 89.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.581 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.37 -42.88 99.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.638 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -62.61 -48.94 77.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.668 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -58.86 -43.14 90.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.425 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 46.2 tp -63.57 -46.92 83.68 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.325 -0.55 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.596 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.43 -37.75 76.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.294 0.569 . . . . 0.0 110.59 -178.001 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 . . . . . 0 C--N 1.317 -0.809 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.416 -179.94 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 38.1 ttm . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.905 0.383 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -68.38 -33.9 75.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -61.74 -34.83 76.52 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -69.87 -38.91 76.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.575 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -68.32 -39.98 81.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.964 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 85.4 m -60.12 -43.01 95.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.312 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.1 tpp -60.27 -46.82 88.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.227 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.02 -46.5 71.05 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.5 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 67.9 t -62.26 -41.89 93.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.402 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 47.9 tp -58.28 -45.79 87.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.12 -39.78 93.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.976 0.417 . . . . 0.0 110.266 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 44.3 tp -60.39 -41.22 93.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.83 -44.43 96.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.116 0.484 . . . . 0.0 110.068 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.01 -45.4 92.52 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.213 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.07 -35.81 78.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.549 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -60.31 -47.45 85.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.489 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.23 -39.23 94.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.065 0.46 . . . . 0.0 110.428 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 78.0 t -68.35 -43.17 84.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.557 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.25 99.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.333 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 46.3 t -156.24 154.74 31.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 110.548 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -81.96 -35.8 28.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.611 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 m 64.95 84.38 0.18 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.224 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.97 147.61 62.4 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 122.725 2.283 . . . . 0.0 112.232 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.469 -179.953 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 61.3 mt . . . . . 0 N--CA 1.462 0.154 0 CA-C-O 121.198 0.523 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -60.84 -43.93 97.64 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.372 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -70.01 -43.88 70.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.036 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.05 -46.73 95.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.603 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -65.01 -37.06 86.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.727 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -59.69 -49.42 77.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.302 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.3 m -59.58 -46.13 89.85 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.863 0.363 . . . . 0.0 110.371 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.0 m -53.22 -43.8 67.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.44 -43.17 97.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.772 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 120.944 0.402 . . . . 0.0 110.842 179.947 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.491 ' O ' HG23 ' A' ' 186' ' ' VAL . 10.9 mp . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 120.552 0.215 . . . . 0.0 110.448 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -50.74 -45.03 58.59 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.128 -177.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.6 m -62.32 -50.41 71.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.14 0.495 . . . . 0.0 110.456 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -65.35 -36.94 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.729 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 182' ' ' LEU . 40.4 t -61.46 -46.29 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.493 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -60.61 -53.61 55.39 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.146 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 47.9 m -58.71 -40.19 82.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.872 0.368 . . . . 0.0 110.432 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 25.4 mt . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.59 179.982 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.523 -0.082 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -120.82 -46.94 2.32 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.545 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.63 -41.59 88.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.748 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.37 -39.36 94.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.0 mm -61.36 -44.16 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.232 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.0 mt -61.9 -41.74 91.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.179 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -59.88 -40.39 88.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.76 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.422 ' HA ' ' HE ' ' A' ' 88' ' ' ARG . 59.9 t-20 -66.65 -52.46 44.75 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.807 0.337 . . . . 0.0 110.943 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.9 -38.31 72.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.017 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.99 -51.75 68.71 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.226 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.422 ' HE ' ' HA ' ' A' ' 85' ' ' ASN . 87.9 mtm180 -54.32 -48.95 70.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.44 -179.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -66.94 -45.16 78.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.398 0.618 . . . . 0.0 110.245 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.3 tt -59.65 -40.66 88.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.273 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.89 -46.92 86.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.382 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.03 -52.18 65.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.27 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.5 t -74.51 -25.99 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.429 0.633 . . . . 0.0 110.719 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.534 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.33 -24.1 76.88 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.862 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.496 ' O ' ' CB ' ' A' ' 96' ' ' SER . 99.6 m-20 -72.58 -46.82 52.45 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.921 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.496 ' CB ' ' O ' ' A' ' 95' ' ' ASP . 1.8 m 158.23 -79.54 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.64 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.438 ' O ' ' O ' ' A' ' 96' ' ' SER . 24.7 mmm 57.87 121.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.453 -179.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 53.21 21.47 2.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.545 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -138.83 -32.49 0.68 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.481 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 7.3 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.955 179.877 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.597 HD12 ' N ' ' A' ' 105' ' ' LEU . 9.1 mp . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 120.867 0.365 . . . . 0.0 110.708 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 107' ' ' ASN . 9.1 p -54.86 -39.01 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.188 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.531 ' OD1' ' N ' ' A' ' 108' ' ' GLY . 45.0 p-10 -58.63 -29.73 66.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.341 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.531 ' N ' ' OD1' ' A' ' 107' ' ' ASN . . . -69.71 -50.38 30.9 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 109' ' ' LEU . 8.7 mp -63.0 -42.38 99.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.929 0.395 . . . . 0.0 110.434 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.94 -49.04 76.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.629 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 72.2 mt -71.01 -44.04 66.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.919 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.3 tm0? -57.63 -41.2 80.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.12 -43.9 97.82 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 119.809 -0.756 . . . . 0.0 110.142 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 84.2 mtt85 -71.87 -28.71 63.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.047 0.451 . . . . 0.0 110.268 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -62.87 -38.09 89.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.738 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 -179.356 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.9 t0 . . . . . 0 C--O 1.232 0.134 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.2 mt -51.24 -33.43 28.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -49.36 69.73 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.435 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.4 m -61.69 -43.15 99.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.99 78.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.429 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -59.49 -41.64 90.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.56 -50.19 72.31 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.163 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -55.33 -45.54 76.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.449 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.56 -47.82 82.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.019 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.548 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -57.39 -41.23 79.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.7 -177.678 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.126 -179.649 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 18.3 tpp . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.665 0.269 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.81 -37.25 86.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.842 0.353 . . . . 0.0 110.756 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -60.54 -38.17 83.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.09 0.471 . . . . 0.0 111.156 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -75.96 -34.54 59.83 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.621 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.554 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 18.8 m -62.1 -44.11 97.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.536 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 19.1 mtm -61.67 -44.03 97.74 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.5 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.8 mt -67.91 -49.57 61.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 78.2 t -62.56 -43.2 98.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.378 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 49.8 tp -58.98 -45.46 90.54 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.439 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.03 -42.53 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.043 0.449 . . . . 0.0 110.275 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 24.2 tp -59.16 -41.85 89.36 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.115 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.4 -44.32 97.35 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.545 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.26 -46.61 82.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.356 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.26 -43.98 80.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.102 0.477 . . . . 0.0 110.43 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.56 -38.7 91.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.128 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -60.52 -41.27 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.321 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 88.5 t -66.38 -45.11 90.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.559 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.15 -35.34 80.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.05 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 35.9 p -157.73 160.93 38.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.198 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . 0.461 ' O ' ' O ' ' A' ' 163' ' ' THR . 55.2 m80 -128.39 50.05 2.12 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.369 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.461 ' O ' ' O ' ' A' ' 162' ' ' HIS . 14.4 p 56.95 147.84 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.0 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.433 ' O ' ' CB ' ' A' ' 165' ' ' SER . 56.8 Cg_endo -70.74 -91.01 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.64 0 C-N-CA 122.153 1.902 . . . . 0.0 111.75 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.6 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 121.112 0.482 . . . . 0.0 110.348 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.581 HD22 ' N ' ' A' ' 167' ' ' LEU . 3.9 mm? . . . . . 0 CA--C 1.523 -0.09 0 CA-C-O 121.058 0.456 . . . . 0.0 110.806 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.09 -43.81 73.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.876 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -66.76 -46.93 73.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.028 0.442 . . . . 0.0 110.913 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.5 -44.27 94.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.421 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . 0.4 ' O ' HG23 ' A' ' 175' ' ' VAL . 81.6 t80 -61.49 -37.62 84.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.486 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.68 -49.71 76.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.411 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.2 m -59.13 -42.51 90.81 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.53 -42.47 87.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.224 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 171' ' ' PHE . 69.6 t -61.76 -37.99 79.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.471 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 120.867 0.365 . . . . 0.0 110.359 -179.609 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 5.1 tp . . . . . 0 CA--C 1.523 -0.082 0 CA-C-O 120.953 0.406 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -51.81 -30.84 24.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.224 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 75.3 m -59.32 -51.42 70.01 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.836 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -70.6 -43.77 68.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.067 0.461 . . . . 0.0 110.889 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 69.6 t -64.35 -43.9 97.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.572 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.57 -45.2 92.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.562 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 37.6 m -59.22 -31.95 69.51 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.351 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.569 HD13 ' O ' ' A' ' 189' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.47 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.181 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.458 -0.059 0 CA-C-O 120.523 0.202 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.581 ' O ' HG22 ' A' ' 82' ' ' ILE . 37.4 tt0 70.88 -49.04 0.67 Allowed 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.463 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -69.36 -33.78 73.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.932 0.396 . . . . 0.0 110.871 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 81' ' ' ASP . 60.0 t0 -47.66 -32.0 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.634 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.581 HG22 ' O ' ' A' ' 79' ' ' GLN . 15.2 tt -61.39 -43.81 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.428 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.484 ' N ' HG23 ' A' ' 82' ' ' ILE . 96.6 mt -65.01 -43.54 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.138 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -50.7 -53.68 29.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.192 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -61.09 -42.08 97.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.598 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.6 mt -60.32 -52.02 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.064 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.24 93.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.194 0.521 . . . . 0.0 110.294 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -54.96 -45.57 74.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.196 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -65.22 -39.55 92.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mt -66.68 -37.97 85.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.422 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.82 -47.74 79.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.173 0.511 . . . . 0.0 110.19 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -62.12 -52.23 64.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -65.5 -27.49 41.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.355 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -64.1 -32.95 85.9 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.41 -44.4 92.86 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.578 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.4 p -161.62 89.54 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.917 0.389 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.5 mtm -60.94 -49.75 76.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.27 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.615 ' C ' ' H ' ' A' ' 100' ' ' SER . 67.8 t0 -176.85 123.81 0.15 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.312 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.6 mtm180 -55.41 1.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.615 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.6 t . . . . . 0 N--CA 1.451 -0.379 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.601 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.688 HD12 ' N ' ' A' ' 105' ' ' LEU . 7.5 mp . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.042 0.449 . . . . 0.0 110.283 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 90.9 t -50.47 -41.7 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.946 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -57.72 -48.31 79.96 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.284 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.49 -51.1 58.65 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.92 -41.2 99.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.005 0.431 . . . . 0.0 110.121 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.69 -39.96 78.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.066 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.55 -44.29 96.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.516 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -68.01 -48.22 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.567 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 tp -61.35 -23.06 65.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.627 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -74.13 -43.99 55.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.795 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -63.23 -41.55 99.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.922 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.348 179.972 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 120.436 0.16 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.552 ' N ' HD22 ' A' ' 127' ' ' LEU . 4.0 mm? -71.63 -43.45 66.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.041 0.448 . . . . 0.0 110.855 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.6 70.18 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.445 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 96.7 m -57.47 -51.49 69.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.356 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.21 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.04 0.448 . . . . 0.0 110.604 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.68 -47.02 82.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.411 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -56.2 -41.84 76.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.284 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -58.24 -45.46 87.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.8 -47.21 75.86 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.231 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.37 -33.76 76.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.628 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.114 179.958 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.8 mtm . . . . . 0 N--CA 1.463 0.196 0 CA-C-O 120.817 0.342 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.467 ' CG ' ' N ' ' A' ' 144' ' ' LYS . 10.1 pt-20 -51.3 -46.35 62.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.424 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . 0.467 ' N ' ' CG ' ' A' ' 143' ' ' GLU . 88.1 tttt -62.88 -48.56 78.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.258 0.551 . . . . 0.0 109.985 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.82 -46.8 77.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.865 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 33.7 mtpt -65.98 -39.47 90.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.783 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 76.8 m -59.94 -47.8 84.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.749 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 74.1 mtm -61.4 -42.12 98.22 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.533 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.54 -43.33 85.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.809 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 64.6 t -67.97 -50.51 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.391 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.87 -44.2 96.74 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.001 0.429 . . . . 0.0 110.773 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.51 -37.74 88.48 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.19 -40.65 96.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.508 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.7 -49.46 77.42 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.789 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 155' ' ' LEU . 4.1 mm? -65.32 -43.4 91.13 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.715 179.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.43 -42.9 82.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.343 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -67.52 -36.73 81.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.344 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.13 -41.97 97.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.551 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 75.5 t -63.62 -45.35 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.681 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -59.62 -51.15 71.06 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.119 -0.633 . . . . 0.0 110.01 -179.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . 0.44 ' O ' ' C ' ' A' ' 162' ' ' HIS . 17.5 t 35.02 -120.55 0.11 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.296 0.373 . . . . 0.0 110.631 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . 0.44 ' C ' ' O ' ' A' ' 161' ' ' SER . 78.9 m-70 31.75 78.78 0.03 OUTLIER 'General case' 0 C--N 1.341 0.217 0 O-C-N 123.216 0.322 . . . . 0.0 111.555 178.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.547 HG21 ' HE ' ' A' ' 168' ' ' ARG . 17.9 m -129.61 80.58 71.51 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.237 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.97 149.88 67.78 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.904 2.403 . . . . 0.0 111.959 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . 0.474 ' O ' ' N ' ' A' ' 167' ' ' LEU . 13.6 p . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.763 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.474 ' N ' ' O ' ' A' ' 165' ' ' SER . 51.5 tp . . . . . 0 N--CA 1.455 -0.224 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.547 ' HE ' HG21 ' A' ' 163' ' ' THR . 99.8 mtt180 -66.59 -37.88 85.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.691 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.52 -47.0 88.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.72 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 80.8 t -68.37 -43.15 84.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.298 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -58.4 -46.68 85.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.691 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . 0.403 ' CD2' ' O ' ' A' ' 168' ' ' ARG . 72.1 m-70 -65.03 -48.81 72.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.943 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.97 -45.92 89.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.4 m -53.35 -44.82 68.83 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.152 0.501 . . . . 0.0 110.214 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.73 -43.13 90.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.421 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 -179.332 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.539 HD12 ' N ' ' A' ' 182' ' ' LEU . 9.7 mp . . . . . 0 CA--C 1.527 0.061 0 CA-C-O 120.803 0.335 . . . . 0.0 110.518 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -53.03 -32.69 48.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.613 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . 0.413 ' HA ' ' HE ' ' A' ' 187' ' ' ARG . 20.2 m -57.22 -47.67 80.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.962 0.411 . . . . 0.0 110.6 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -67.55 -35.58 79.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.531 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 88.2 t -64.77 -43.9 96.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.549 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . 0.413 ' HE ' ' HA ' ' A' ' 184' ' ' THR . 87.8 mtm180 -60.34 -48.99 79.38 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.552 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 67.0 m -61.43 -42.36 98.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.851 0.358 . . . . 0.0 110.637 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 4.9 tp . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.578 -179.85 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.1 t . . . . . 0 N--CA 1.46 0.05 0 CA-C-O 120.775 0.321 . . . . 0.0 110.654 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -58.61 -8.39 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.567 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -62.23 -36.77 83.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.396 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -60.21 -48.29 82.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.432 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.3 mt -66.44 -43.68 90.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.447 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.31 -43.63 98.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.238 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 78.6 ttt-85 -56.09 -48.04 76.87 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -60.79 -42.74 98.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.038 0.447 . . . . 0.0 110.658 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 82.9 mt -60.52 -45.38 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.05 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.64 -39.04 93.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.119 0.485 . . . . 0.0 110.197 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -56.69 -48.62 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.906 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.24 -45.85 89.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.246 0.546 . . . . 0.0 110.49 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.522 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.1 mt -63.8 -39.41 94.18 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.462 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.479 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.39 -46.9 76.54 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.417 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.6 tp60 -64.53 -52.38 58.02 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.163 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.7 t -65.32 -25.96 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.392 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.16 -32.38 14.33 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.404 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.479 ' N ' ' O ' ' A' ' 91' ' ' ALA . 64.7 t0 -70.69 -46.85 62.39 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.999 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.525 ' C ' ' H ' ' A' ' 98' ' ' ASP . 57.4 m -51.34 -105.93 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.815 0.34 . . . . 0.0 110.991 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 mmt 55.38 4.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.213 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.525 ' H ' ' C ' ' A' ' 96' ' ' SER . 98.1 m-20 -76.45 -67.11 0.72 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.344 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -90.09 -30.39 17.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.632 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.9 m . . . . . 0 CA--C 1.518 -0.273 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.261 -179.931 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.618 HD22 ' N ' ' A' ' 105' ' ' LEU . 3.7 mm? . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 120.946 0.403 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.61 HG13 ' N ' ' A' ' 107' ' ' ASN . 14.5 p -58.96 -48.44 86.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.405 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.61 ' N ' HG13 ' A' ' 106' ' ' VAL . 36.3 t30 -57.46 -34.37 68.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.361 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.79 -39.66 95.27 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 51.3 tp -60.43 -42.05 95.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 110.695 -179.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.82 -48.8 80.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.149 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.06 -42.26 76.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.245 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -50.84 -37.54 43.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.79 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 64.6 mt -62.33 -43.28 99.2 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.199 -0.6 . . . . 0.0 109.992 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -55.65 -41.95 74.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.0 110.03 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -63.2 -39.78 95.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.387 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 45.0 p . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.755 -179.734 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.8 t0 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 120.823 0.344 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.892 HD22 ' N ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -49.23 -28.69 4.83 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.732 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.892 ' N ' HD22 ' A' ' 127' ' ' LEU . . . -56.58 -39.58 73.75 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.14 0.495 . . . . 0.0 109.971 -178.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 88.0 m -61.79 -42.37 98.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.697 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.15 79.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.227 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -58.93 -44.91 91.45 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.385 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -67.06 -45.96 75.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.067 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -64.97 -37.0 86.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.78 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.6 tp -59.28 -54.49 46.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.362 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.77 -38.5 90.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.719 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 . . . . . 0 C--N 1.321 -0.655 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.435 -179.207 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . 0.459 ' CG ' ' N ' ' A' ' 143' ' ' GLU . 12.8 ptm . . . . . 0 N--CA 1.454 -0.251 0 CA-C-O 120.94 0.4 . . . . 0.0 110.384 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 142' ' ' MET . 81.4 tt0 -66.64 -42.87 86.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.021 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.59 -29.8 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.684 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.55 -50.31 63.58 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.605 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.443 ' O ' HG23 ' A' ' 150' ' ' VAL . 20.2 ptmt -72.85 -30.16 63.78 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.827 -0.545 . . . . 0.0 110.819 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 68.4 m -60.24 -46.22 90.52 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.314 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 66.4 mtt -64.91 -46.58 81.1 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.581 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.5 mp -66.09 -47.29 74.73 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.032 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 146' ' ' LYS . 57.0 t -62.51 -43.66 98.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.038 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.3 tp -53.12 -46.3 68.71 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.2 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.33 -35.98 82.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tp -59.25 -44.83 92.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.536 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.83 -44.41 96.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.048 0.451 . . . . 0.0 110.143 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.3 -43.74 90.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.055 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.69 -44.99 69.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.686 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . 0.427 ' O ' ' O ' ' A' ' 161' ' ' SER . 25.9 tptp -61.99 -40.59 96.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.572 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -62.39 -45.47 93.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.37 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.75 -43.99 82.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.687 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.94 -37.44 87.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.179 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 157' ' ' LYS . 41.1 t -172.36 176.84 3.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.275 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -128.2 142.67 51.1 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.829 0.347 . . . . 0.0 110.124 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.531 ' CB ' HH21 ' A' ' 168' ' ' ARG . 1.1 p -84.89 153.41 60.44 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.586 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.22 -162.38 0.1 OUTLIER 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 122.592 2.195 . . . . 0.0 111.83 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 61.6 p . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.478 -179.867 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 55.1 mt . . . . . 0 C--O 1.232 0.149 0 CA-C-O 121.017 0.437 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.531 HH21 ' CB ' ' A' ' 163' ' ' THR . 63.1 ttm-85 -60.06 -45.59 92.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.24 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.79 -46.03 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.935 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 75.6 t -63.22 -45.3 98.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.438 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -61.12 -38.23 85.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.095 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -59.75 -46.83 87.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.591 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.7 m -61.24 -46.99 88.1 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.6 m -52.59 -43.71 65.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.446 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 72.1 t -62.69 -43.41 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.292 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . 0.444 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 54.7 t-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 121.292 0.568 . . . . 0.0 110.649 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 186' ' ' VAL . 10.9 mp . . . . . 0 N--CA 1.451 -0.417 0 CA-C-O 120.595 0.236 . . . . 0.0 110.626 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 90.1 mtm-85 -51.75 -49.71 62.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.342 -178.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 96.7 m -66.78 -49.65 65.21 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.106 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -62.3 -43.89 97.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.704 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 182' ' ' LEU . 46.8 t -59.59 -42.97 89.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.005 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -56.2 -53.88 51.91 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.797 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 9.9 p -62.83 -41.47 99.35 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.591 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.504 HD22 ' N ' ' A' ' 189' ' ' LEU . 4.2 mm? . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.345 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.657 0.265 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -172.85 -73.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.36 -35.55 81.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.187 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -61.61 -41.52 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.493 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.429 ' O ' HD13 ' A' ' 86' ' ' ILE . 22.1 mm -62.06 -49.06 85.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.104 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.6 -42.53 94.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.167 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -51.46 -54.59 25.34 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.882 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -53.89 -44.02 70.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.944 0.402 . . . . 0.0 110.912 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 82' ' ' ILE . 1.5 mp -63.4 -49.88 80.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 120.288 -0.565 . . . . 0.0 109.511 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.483 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -60.37 -37.69 81.53 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.948 -179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -58.56 -47.19 85.05 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.561 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -68.88 -46.98 67.0 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.223 0.535 . . . . 0.0 110.854 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.71 -35.47 78.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.771 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.483 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -64.1 -42.74 96.78 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.408 ' NE2' ' C ' ' A' ' 92' ' ' GLN . 0.6 OUTLIER -64.05 -52.72 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.509 -179.572 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.3 p -73.67 -27.09 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.216 0.531 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -78.37 -35.8 32.36 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.74 -47.05 82.58 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.788 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.9 m -163.48 143.59 8.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.34 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 ttm -72.41 98.44 2.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.286 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.452 ' O ' ' CB ' ' A' ' 99' ' ' ARG . 66.4 t0 41.75 42.59 2.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.317 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.452 ' CB ' ' O ' ' A' ' 98' ' ' ASP . 7.9 tpt180 80.07 -74.18 0.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.307 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.7 p . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.749 -179.832 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 59.6 mt . . . . . 0 CA--C 1.523 -0.096 0 CA-C-O 120.766 0.317 . . . . 0.0 110.525 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 99.3 t -61.21 -45.1 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.215 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -62.7 -41.4 99.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.92 -21.94 11.2 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.7 mt -61.53 -40.05 93.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.77 0.319 . . . . 0.0 110.579 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.14 -44.79 44.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.679 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.545 HD22 ' N ' ' A' ' 111' ' ' LEU . 3.9 mm? -65.67 -34.73 78.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.928 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -69.03 -47.16 66.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.388 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.99 -42.92 97.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.225 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -63.03 -46.2 88.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.195 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -70.81 -40.63 72.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.464 0.225 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.4 -179.707 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 64.4 t0 . . . . . 0 CA--C 1.519 -0.213 0 N-CA-C 110.549 -0.167 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.0 -40.46 91.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 120.796 0.332 . . . . 0.0 111.149 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -38.72 66.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.494 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 55.8 m -72.91 -42.77 63.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.75 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.02 87.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.079 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.9 -47.12 86.4 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.83 0.348 . . . . 0.0 110.716 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -55.07 -41.12 71.09 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.18 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -67.92 -38.47 82.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.661 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.74 -54.46 46.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.595 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.495 ' N ' HD12 ' A' ' 135' ' ' LEU . 8.2 mp -65.32 -40.26 93.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.012 0.434 . . . . 0.0 110.614 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.341 179.494 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 120.858 0.361 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -63.61 -34.81 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.785 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -60.9 -38.09 84.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.006 0.431 . . . . 0.0 110.241 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -62.04 -45.55 93.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.424 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.489 ' O ' HG23 ' A' ' 150' ' ' VAL . 99.1 mttt -66.92 -32.94 74.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 19.3 m -58.92 -45.46 90.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.259 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.7 mtt -63.16 -45.98 89.32 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.658 -0.417 . . . . 0.0 109.954 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.95 -42.65 80.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 146' ' ' LYS . 42.9 t -62.71 -43.17 98.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.285 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.27 -47.49 85.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.429 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.99 87.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.181 0.515 . . . . 0.0 109.728 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 5.6 tp -59.08 -40.77 86.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.168 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 29.1 mt -61.22 -44.73 96.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.966 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.7 -46.45 82.32 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.181 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.18 96.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.15 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -63.38 -38.94 93.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.301 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -58.17 -42.32 85.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.717 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.5 t -65.59 -46.07 90.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.281 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -69.1 -32.89 72.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.047 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 11.3 t -31.39 94.7 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.124 0.488 . . . . 0.0 110.996 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . 0.511 ' CG ' ' O ' ' A' ' 161' ' ' SER . 89.2 m-70 -159.83 41.91 0.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.151 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.544 ' N ' ' CD ' ' A' ' 164' ' ' PRO . 0.5 OUTLIER -128.25 48.12 3.26 Favored Pre-proline 0 N--CA 1.466 0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.351 179.507 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 163' ' ' THR . 36.4 Cg_endo -66.1 140.71 60.73 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.503 2.136 . . . . 0.0 111.738 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.4 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.432 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.598 ' C ' HD12 ' A' ' 167' ' ' LEU . 1.6 pp . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 120.983 0.42 . . . . 0.0 110.466 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -62.09 -47.09 86.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . 0.4 ' OD1' ' O ' ' A' ' 169' ' ' ASP . 66.7 t0 -66.71 -38.71 87.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.54 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 84.8 t -61.95 -46.51 96.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.586 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -61.21 -41.3 96.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.837 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.95 -49.71 76.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.501 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 85.2 m -60.07 -42.47 94.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.547 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.2 m -56.31 -43.19 78.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.435 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.0 t -61.33 -43.13 96.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.542 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.797 179.839 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 53.9 tp . . . . . 0 N--CA 1.454 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.739 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -56.73 -32.78 65.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.415 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 69.3 m -61.0 -49.07 78.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -68.91 -42.22 77.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.027 0.441 . . . . 0.0 110.316 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.98 -42.69 97.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.682 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -58.95 -44.73 91.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.298 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.3 t -61.23 -44.48 97.2 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.775 0.321 . . . . 0.0 110.518 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 50.8 tp . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.55 -179.704 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.0 m . . . . . 0 N--CA 1.465 0.31 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? 70.92 -56.52 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -65.22 -33.82 76.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.0 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -58.48 -45.4 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.525 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.46 -43.77 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.408 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.7 mt -62.41 -43.36 98.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -53.46 -53.18 55.09 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -58.1 -42.37 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.699 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.54 -51.59 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.011 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -61.81 -38.2 87.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.338 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -55.96 -47.51 77.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.607 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -66.23 -45.17 81.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.507 . . . . 0.0 110.826 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.451 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.3 mt -68.44 -33.6 74.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.471 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.46 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -58.78 -46.48 87.45 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.132 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.32 -51.99 60.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.077 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.39 -26.16 38.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.17 -22.96 42.59 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -63.13 -43.85 97.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.703 0.287 . . . . 0.0 111.077 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.582 ' C ' ' H ' ' A' ' 98' ' ' ASP . 32.7 t -165.83 -75.88 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.581 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.9 tpt 66.67 -14.25 0.16 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.358 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.582 ' H ' ' C ' ' A' ' 96' ' ' SER . 95.1 m-20 -72.03 -19.45 61.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.219 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -68.89 -41.22 78.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.68 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 77.0 p . . . . . 0 CA--C 1.515 -0.4 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.731 -179.771 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.418 ' N ' HD12 ' A' ' 105' ' ' LEU . 10.9 mp . . . . . 0 CA--C 1.531 0.245 0 CA-C-O 120.539 0.209 . . . . 0.0 110.484 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 69.2 t -64.92 -45.79 93.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.947 0.403 . . . . 0.0 110.249 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -64.22 -32.19 73.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.999 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -61.6 -35.25 90.86 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.03 -38.29 88.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.539 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -56.97 -47.56 80.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.385 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 111' ' ' LEU . 5.1 tt -65.53 -46.24 80.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.586 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -50.86 -36.35 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.647 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.4 mt -61.49 -42.98 99.61 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.234 -0.586 . . . . 0.0 109.663 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -56.5 -42.54 78.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 110.151 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.86 -37.84 88.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.305 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 46.1 p . . . . . 0 N--CA 1.463 0.202 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.755 -179.993 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.7 t0 . . . . . 0 N--CA 1.449 -0.508 0 N-CA-C 110.706 -0.109 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.586 ' N ' HD22 ' A' ' 127' ' ' LEU . 3.6 mm? -71.49 -42.96 67.42 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.141 0.496 . . . . 0.0 111.16 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.85 -28.73 69.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.567 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 6.0 m -60.42 -49.85 75.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.154 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.14 -45.65 90.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.29 -41.99 96.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.644 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -55.33 -45.02 76.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.138 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -61.91 -47.05 86.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.726 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.4 tp -64.5 -49.12 72.58 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.456 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.599 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.08 -31.95 67.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.231 0.539 . . . . 0.0 110.214 -178.125 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.681 -179.293 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.73 0.3 . . . . 0.0 110.748 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -65.23 -44.6 87.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.009 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.13 -34.15 77.72 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.148 -179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -64.92 -43.32 93.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.069 0.462 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 150' ' ' VAL . 51.7 mtmt -66.46 -36.18 82.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.582 179.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 58.5 m -58.56 -43.77 89.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.262 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mmm -61.36 -46.56 89.72 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.356 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.0 -43.82 81.91 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.122 0.487 . . . . 0.0 110.673 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 146' ' ' LYS . 47.1 t -60.68 -45.28 97.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.563 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 36.3 mt -58.13 -45.66 86.95 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.434 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.85 -40.43 91.72 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.389 -0.525 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.23 -45.28 84.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.267 -178.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.54 -44.04 97.77 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.746 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.598 ' O ' HD23 ' A' ' 155' ' ' LEU . 4.0 tt -65.08 -51.66 60.14 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.031 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.68 -41.87 98.1 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.758 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -63.79 -36.73 84.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.311 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -62.32 -39.36 92.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.385 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.9 t -67.89 -49.47 68.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.668 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . 0.483 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -70.89 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.325 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . 0.513 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 38.5 t -24.7 90.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.812 0.695 . . . . 0.0 111.186 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . 0.513 ' CG ' ' O ' ' A' ' 161' ' ' SER . 70.3 m-70 -160.74 38.25 0.16 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.423 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 p -101.26 150.41 37.13 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.631 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.63 166.08 30.54 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 122.807 2.338 . . . . 0.0 111.782 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 N--CA 1.463 0.208 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.645 179.83 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 62.0 mt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 121.015 0.436 . . . . 0.0 110.371 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -60.59 -45.45 93.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.099 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -65.48 -42.02 92.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.583 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 83.6 t -62.3 -44.64 99.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.325 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.17 -40.61 81.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -60.69 -44.48 96.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.418 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 11.9 m -64.89 -40.24 94.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.795 0.331 . . . . 0.0 110.618 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.7 m -58.35 -50.74 72.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.984 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.9 -33.36 61.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.584 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.062 179.625 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.563 ' N ' HD12 ' A' ' 182' ' ' LEU . 9.8 mp . . . . . 0 C--O 1.223 -0.306 0 CA-C-O 120.796 0.332 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -51.79 -43.72 63.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.471 -177.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.1 m -61.86 -52.25 64.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.81 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -66.65 -41.65 87.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.004 0.431 . . . . 0.0 110.965 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 182' ' ' LEU . 74.6 t -64.19 -43.44 97.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.554 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -57.68 -52.52 65.11 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.449 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 57.1 m -58.48 -49.04 78.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.701 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 49.2 tp . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.425 179.542 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.895 0.378 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -63.58 -37.2 86.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.372 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -60.31 -36.77 78.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.33 -49.71 75.9 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.875 0.369 . . . . 0.0 110.661 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 94.3 mt -64.54 -43.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.284 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.03 -43.27 97.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.787 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttm-85 -53.43 -53.69 47.63 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -58.0 -44.0 86.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.031 0.443 . . . . 0.0 110.632 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 93.1 mt -61.43 -50.47 80.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.563 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.09 -39.92 83.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.515 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 62.1 ttt85 -54.4 -45.71 72.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.034 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -63.31 -44.62 94.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.484 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.2 mt -64.66 -39.25 93.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.558 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.85 -44.56 74.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.117 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -64.51 -51.77 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.31 179.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -26.29 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.665 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.11 -19.79 56.64 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -62.74 -46.88 86.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.775 0.321 . . . . 0.0 110.536 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.0 m -77.41 -69.87 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.865 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.4 ttp -76.93 -177.66 4.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.13 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 55.75 36.37 27.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.764 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -105.81 2.04 27.44 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.643 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 120.933 0.397 . . . . 0.0 110.883 -179.817 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 N--CA 1.462 0.148 0 CA-C-O 120.815 0.34 . . . . 0.0 110.579 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.515 HG23 ' N ' ' A' ' 107' ' ' ASN . 35.7 m -64.17 -43.75 97.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.271 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.515 ' N ' HG23 ' A' ' 106' ' ' VAL . 27.2 t-20 -64.62 -50.56 66.68 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.966 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -63.08 -31.44 80.72 Favored Glycine 0 CA--C 1.522 0.507 0 N-CA-C 110.739 -0.945 . . . . 0.0 110.739 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.6 -48.45 81.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -47.74 84.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.443 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.55 ' O ' HD13 ' A' ' 111' ' ' LEU . 0.2 OUTLIER -64.22 -45.75 86.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.123 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.44 ' O ' ' OD1' ' A' ' 115' ' ' ASN . 58.1 tt0 -61.73 -35.31 77.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.031 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.2 tp -64.23 -33.42 75.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.392 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . 0.453 ' C ' ' N ' ' A' ' 116' ' ' THR . 61.3 ttp180 -60.0 -40.76 90.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.741 -179.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 116' ' ' THR . 33.1 p-10 -48.82 -13.96 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.668 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.454 ' N ' ' OD1' ' A' ' 115' ' ' ASN . 99.5 m . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.692 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 39.2 t70 . . . . . 0 CA--C 1.522 -0.116 0 CA-C-O 120.617 0.246 . . . . 0.0 110.796 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 pp -59.75 -31.66 69.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.702 0.286 . . . . 0.0 110.837 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.14 -40.35 70.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.18 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 27.0 m -60.79 -50.7 72.41 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.102 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.5 73.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.245 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.64 -46.23 89.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.137 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.28 -47.93 59.01 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.625 -0.43 . . . . 0.0 109.991 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -59.82 -43.55 94.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.671 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 5.7 tt -64.14 -41.27 97.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.978 0.418 . . . . 0.0 110.703 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -27.69 46.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 . . . . . 0 C--N 1.323 -0.578 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.023 -179.433 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 39.0 ttm . . . . . 0 N--CA 1.473 0.707 0 CA-C-O 120.98 0.419 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -66.06 -48.09 72.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.282 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -63.69 -36.46 83.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.143 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -71.32 -45.95 61.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.882 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -57.78 -49.45 76.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.419 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 3.5 m -64.41 -50.24 68.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.007 0.432 . . . . 0.0 110.514 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 21.8 ttp -62.13 -34.88 77.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.65 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 46.1 tp -59.67 -48.25 82.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.188 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.52 -43.96 95.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.568 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 56.7 tp -61.38 -45.88 92.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.379 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.92 73.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.405 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.4 tp -66.47 -39.39 88.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.43 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 37.6 mt -61.51 -45.83 92.55 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.466 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.421 HD22 ' N ' ' A' ' 155' ' ' LEU . 4.1 mm? -65.95 -39.81 90.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.681 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.22 -42.19 66.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.526 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -66.72 -41.78 87.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.689 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -61.49 -45.32 94.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.575 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 69.5 t -63.42 -44.89 99.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.38 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.48 -39.23 92.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.832 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 47.0 m -164.89 164.37 20.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -122.04 134.61 54.79 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . 0.475 ' OG1' ' NH2' ' A' ' 168' ' ' ARG . 0.5 OUTLIER -90.24 157.3 45.34 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 120.641 0.257 . . . . 0.0 110.541 -179.371 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 163' ' ' THR . 76.3 Cg_exo -42.19 170.05 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.411 2.074 . . . . 0.0 111.959 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 79.9 p . . . . . 0 N--CA 1.466 0.331 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.623 179.796 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.503 ' N ' HD12 ' A' ' 167' ' ' LEU . 10.8 mp . . . . . 0 N--CA 1.463 0.182 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.475 ' NH2' ' OG1' ' A' ' 163' ' ' THR . 9.7 ptp180 -71.17 -34.44 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.608 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . 0.493 ' O ' HG23 ' A' ' 173' ' ' THR . 91.3 m-20 -62.31 -46.89 86.72 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.96 -179.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.449 ' O ' ' OG1' ' A' ' 173' ' ' THR . 7.5 p -69.97 -33.28 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.133 0.492 . . . . 0.0 110.119 179.152 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -59.16 -46.28 88.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.115 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -65.32 -42.24 93.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . 0.493 HG23 ' O ' ' A' ' 169' ' ' ASP . 51.9 p -58.21 -46.09 86.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.348 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.8 m -59.63 -44.63 93.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.917 0.389 . . . . 0.0 110.341 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.79 -44.28 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.481 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.334 -179.15 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -59.11 -37.58 77.52 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.209 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -60.55 -46.99 88.15 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.392 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -64.0 -35.59 81.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 182' ' ' LEU . 62.0 t -59.82 -45.62 94.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.213 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.45 -49.9 73.58 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.691 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.5 t -59.96 -41.68 92.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.442 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.51 ' N ' HD22 ' A' ' 189' ' ' LEU . 3.8 mm? . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.687 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.2 m . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.877 0.37 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . 0.414 HE22 HD11 ' A' ' 83' ' ' ILE . 1.9 tm0? 72.08 -64.61 0.38 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.311 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -65.3 -47.0 78.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.574 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -65.88 -33.96 77.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.353 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.68 -43.37 98.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.857 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.414 HD11 HE22 ' A' ' 79' ' ' GLN . 94.2 mt -63.44 -43.84 98.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.201 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.62 -55.49 23.2 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -53.2 -46.25 68.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.3 mm -62.15 -45.58 98.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 179.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -50.88 -35.08 31.02 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.826 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.8 mmt-85 -66.15 -50.01 65.44 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.815 0.34 . . . . 0.0 110.091 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -69.44 -50.42 45.8 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.109 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.573 ' O ' HD23 ' A' ' 90' ' ' LEU . 1.3 tt -53.88 -41.68 67.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.004 0.431 . . . . 0.0 109.853 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.95 -48.51 81.51 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.922 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -64.47 -51.94 60.51 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.412 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.418 HG12 ' HA ' ' A' ' 90' ' ' LEU . 3.1 p -68.62 -31.84 52.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 109.894 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -60.23 -34.25 83.64 Favored Glycine 0 CA--C 1.519 0.292 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.41 -47.56 84.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.129 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.3 m -114.01 111.78 22.21 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.132 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 79.7 mtp -85.38 -102.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 43.9 t0 50.99 18.99 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.601 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -140.58 -53.46 0.5 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.2 p . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.25 -179.945 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.708 ' N ' HD12 ' A' ' 105' ' ' LEU . 6.4 mp . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.751 0.31 . . . . 0.0 110.735 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 107' ' ' ASN . 33.7 m -59.3 -50.4 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.913 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.605 ' N ' HG23 ' A' ' 106' ' ' VAL . 20.6 t-20 -57.36 -46.65 83.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.228 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.5 -42.57 95.67 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.083 -1.207 . . . . 0.0 110.083 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 tp -59.42 -40.84 88.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.78 -37.44 87.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.6 tp -61.74 -48.75 79.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.866 0.365 . . . . 0.0 111.27 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.555 ' O ' ' N ' ' A' ' 116' ' ' THR . 16.4 pt20 -71.92 -45.17 62.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.033 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.99 -25.79 65.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.3 -179.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -79.33 -49.2 12.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.54 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -89.35 -56.71 3.15 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.053 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.555 ' N ' ' O ' ' A' ' 112' ' ' GLN . 1.7 m . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.031 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 42.4 t0 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 120.674 0.273 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.31 -41.26 70.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.124 0.488 . . . . 0.0 111.175 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.77 -28.58 70.08 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.791 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 96.6 m -59.67 -52.68 64.47 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.099 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.16 -47.34 74.33 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.817 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 30.5 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.379 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -53.6 -39.04 64.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.919 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -64.17 -36.55 84.41 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.562 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -61.64 -48.94 78.6 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.545 -178.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.472 HD22 ' N ' ' A' ' 135' ' ' LEU . 4.2 mm? -61.3 -29.76 70.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.435 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.279 179.916 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 2.5 ttt . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.874 0.369 . . . . 0.0 110.559 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -65.36 -35.43 80.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.599 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -63.37 -40.99 98.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.776 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . 0.475 ' OE1' ' N ' ' A' ' 145' ' ' GLU . 57.9 mp0 -67.7 -52.45 37.59 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.794 -0.762 . . . . 0.0 109.51 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -53.15 -38.76 63.02 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.555 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 16.8 m -61.85 -43.31 99.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.511 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 50.6 mtt -62.66 -39.42 93.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.747 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.437 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.6 t -61.69 -42.3 93.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.281 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.41 -44.99 92.76 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.203 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.08 -31.5 72.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.818 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.74 -39.96 69.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.43 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 16.3 mt -60.87 -42.14 97.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.039 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.505 ' O ' HD13 ' A' ' 155' ' ' LEU . 0.2 OUTLIER -62.35 -49.79 74.15 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.667 -179.657 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.8 -36.04 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.621 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -62.27 -45.66 92.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.583 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.13 -41.39 98.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.768 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.7 t -61.51 -46.65 96.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.485 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.41 -48.81 76.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.971 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 37.2 t -162.94 158.98 23.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.456 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -134.21 133.14 40.55 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.933 0.397 . . . . 0.0 110.429 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.12 155.0 80.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.322 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.51 -19.4 54.8 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.627 2.218 . . . . 0.0 111.867 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . 0.525 ' O ' ' N ' ' A' ' 167' ' ' LEU . 7.7 t . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.256 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 165' ' ' SER . 47.5 mt . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.889 0.376 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -62.55 -43.51 98.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . 0.442 ' O ' HG23 ' A' ' 173' ' ' THR . 98.8 m-20 -63.25 -44.14 96.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.651 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.444 ' O ' ' OG1' ' A' ' 173' ' ' THR . 71.0 t -63.41 -47.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.881 0.372 . . . . 0.0 110.398 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.07 -47.0 86.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.439 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -64.26 -40.34 95.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . 0.444 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 8.9 p -62.94 -43.76 97.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.607 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.7 m -61.97 -50.46 72.02 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.473 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.6 t -62.08 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.213 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 -179.728 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.407 ' O ' HG22 ' A' ' 186' ' ' VAL . 53.7 tp . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.505 0.193 . . . . 0.0 110.505 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -51.45 -34.96 37.57 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.572 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -66.03 -50.59 63.69 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -61.83 -47.97 82.69 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.022 0.439 . . . . 0.0 111.686 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.407 HG22 ' O ' ' A' ' 182' ' ' LEU . 23.0 m -66.59 -32.97 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.253 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -59.67 -48.99 79.48 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.506 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.6 t -61.41 -42.75 99.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.76 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.365 -179.894 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.3 m . . . . . 0 N--CA 1.465 0.308 0 CA-C-O 121.067 0.461 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -65.33 -34.16 77.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.67 -33.74 76.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -61.91 -35.6 78.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.068 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.406 ' O ' HG22 ' A' ' 86' ' ' ILE . 95.6 mt -62.48 -45.42 98.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.216 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.533 ' O ' ' HB2' ' A' ' 87' ' ' ALA . 97.2 mt -65.99 -41.55 89.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.241 0.543 . . . . 0.0 110.388 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -69.12 -44.62 72.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.435 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -61.12 -56.18 23.88 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.035 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.473 HG23 ' N ' ' A' ' 87' ' ' ALA . 18.8 tt -61.47 -41.19 89.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.441 0.639 . . . . 0.0 109.756 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 83' ' ' ILE . . . -51.02 -40.21 57.67 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -68.58 -44.38 74.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.34 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -62.83 -50.34 71.34 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.8 mt -52.13 -39.82 60.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.126 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.96 -49.04 79.07 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.857 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.74 -50.77 55.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.284 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.473 HG22 HH21 ' A' ' 99' ' ' ARG . 87.3 t -60.23 -42.32 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.193 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -53.96 -43.42 71.8 Favored Glycine 0 CA--C 1.519 0.335 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -76.2 -47.16 25.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.542 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 98' ' ' ASP . 18.3 m -61.16 -71.8 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.532 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 73.7 mmm 66.07 -41.65 0.36 Allowed 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.693 0.621 . . . . 0.0 110.656 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.52 ' H ' ' C ' ' A' ' 96' ' ' SER . 68.2 t0 -61.88 -40.07 94.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.489 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.473 HH21 HG22 ' A' ' 93' ' ' VAL . 71.8 ttp85 -64.66 -43.36 93.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.401 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 51.5 m . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.381 -179.855 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.56 HD22 ' N ' ' A' ' 105' ' ' LEU . 3.7 mm? . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 13.8 p -70.77 -35.06 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.563 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -61.12 -40.84 95.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.509 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.13 -51.18 58.56 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 60.4 tp -62.86 -42.6 99.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.543 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.4 -48.48 81.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 tp -64.82 -45.06 87.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.742 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -67.77 -26.9 66.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.667 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.432 ' O ' ' OG1' ' A' ' 116' ' ' THR . 57.1 tp -61.51 -43.0 99.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.135 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -59.79 -34.11 72.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.836 0.351 . . . . 0.0 110.369 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -58.74 -40.37 83.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.224 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 113' ' ' LEU . 45.5 p . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.489 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.1 t0 . . . . . 0 N--CA 1.455 -0.194 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 31.8 mt -52.8 -38.24 60.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.535 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.12 -47.84 71.4 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 81.8 m -62.36 -43.75 98.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.861 0.362 . . . . 0.0 110.455 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.96 -47.5 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.537 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -61.57 -42.43 98.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.404 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -64.03 -52.71 58.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.058 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -61.33 -44.62 96.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.683 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.31 -51.12 65.05 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.4 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' A' ' 135' ' ' LEU . 41.4 tp -57.72 -38.89 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.302 -178.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.591 179.409 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 50.1 mtt . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.871 0.367 . . . . 0.0 110.642 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -67.25 -32.66 73.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.598 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -58.38 -43.34 88.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.667 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -66.49 -51.87 52.11 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.545 ' O ' HG23 ' A' ' 150' ' ' VAL . 97.7 mttt -52.69 -40.9 63.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.313 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.5 m -59.83 -51.49 69.5 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.758 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 78.0 mtm -68.66 -40.0 80.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.017 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 62.9 mt -63.61 -43.18 97.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.691 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 146' ' ' LYS . 40.9 t -60.78 -44.73 98.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.217 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 54.4 tp -61.02 -46.74 89.51 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.51 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.43 -35.91 81.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.5 tp -70.28 -35.68 73.9 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.929 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.566 ' O ' HD13 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -61.18 -45.96 92.47 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.868 -178.871 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.32 -46.06 91.84 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.313 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.2 -45.18 74.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.535 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -64.25 -36.54 84.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.339 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.29 -47.17 86.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.276 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 96.0 t -64.93 -45.26 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.708 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -57.36 -48.55 78.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.26 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . 0.506 ' C ' ' CG ' ' A' ' 162' ' ' HIS . 97.9 p -110.13 -133.11 0.33 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.559 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . 0.506 ' CG ' ' C ' ' A' ' 161' ' ' SER . 0.1 OUTLIER -179.99 165.78 1.23 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.974 0.416 . . . . 0.0 109.953 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 4.6 p -73.02 149.76 89.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.65 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.68 -88.27 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.528 2.152 . . . . 0.0 112.307 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . 0.49 ' O ' ' NE ' ' A' ' 168' ' ' ARG . 15.7 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.607 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 50.4 mt . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.699 0.285 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.497 ' CG ' ' N ' ' A' ' 169' ' ' ASP . 14.8 ptp180 -60.95 -45.61 94.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.519 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . 0.497 ' N ' ' CG ' ' A' ' 168' ' ' ARG . 67.1 t0 -65.26 -40.76 94.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.68 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.9 t -61.37 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.305 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -57.09 -47.29 81.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.46 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . 0.692 ' CD2' HD21 ' A' ' 176' ' ' ASN . 73.5 t60 -61.55 -37.02 82.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.22 0.533 . . . . 0.0 110.142 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 79.4 m -65.78 -43.23 89.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.764 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 96.3 m -58.44 -52.36 65.95 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.939 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.4 p -60.66 -38.17 77.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.06 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . 0.692 HD21 ' CD2' ' A' ' 172' ' ' HIS . 92.5 m-20 . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.575 HD13 ' O ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.153 0 CA-C-O 121.077 0.465 . . . . 0.0 110.502 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -57.18 -46.71 82.58 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.21 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 15.3 m -57.23 -43.3 82.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.328 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -66.05 -34.18 77.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.007 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 182' ' ' LEU . 43.7 t -59.91 -48.55 87.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.559 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -62.28 -52.73 62.55 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.147 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 96.5 p -57.99 -22.05 47.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.767 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.566 HD13 ' O ' ' A' ' 189' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.352 -179.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.0 m . . . . . 0 CA--C 1.522 -0.1 0 CA-C-O 121.002 0.43 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -52.3 -29.63 24.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.588 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.26 -38.98 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.44 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.06 -43.54 98.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 87.9 mt -63.02 -43.16 98.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.615 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.1 mt -61.34 -42.4 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -54.01 -54.69 35.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -54.79 -40.17 69.19 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.687 0.279 . . . . 0.0 110.427 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.41 HD13 ' HA ' ' A' ' 86' ' ' ILE . 29.0 mm -64.49 -46.36 92.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.323 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.7 90.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.649 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -59.4 -48.96 79.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.823 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -66.79 -40.54 88.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.089 0.471 . . . . 0.0 110.118 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.542 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.2 tt -67.24 -37.43 83.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.511 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.59 -47.8 83.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.75 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -64.74 -52.17 58.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.554 -0.459 . . . . 0.0 110.153 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.88 -26.74 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.578 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -76.14 -31.28 55.61 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -61.76 -46.98 87.24 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p -66.48 -32.05 73.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.554 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 60.8 ttp -61.35 -36.18 79.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.388 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.54 -17.22 59.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.939 0.4 . . . . 0.0 110.314 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -59.38 -44.92 92.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.072 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.465 0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.139 179.547 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.684 ' N ' HD23 ' A' ' 105' ' ' LEU . 1.8 pt? . . . . . 0 CA--C 1.527 0.079 0 CA-C-O 120.905 0.383 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 66.2 t -58.93 -46.13 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.403 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -59.87 -45.05 93.72 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.087 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -77.15 -22.66 70.54 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.457 ' N ' ' O ' ' A' ' 105' ' ' LEU . 53.4 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.325 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.04 -48.07 77.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.322 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.76 -43.36 93.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.428 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -44.86 75.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.258 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 tp -63.51 -44.64 93.7 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.388 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -51.37 -38.28 52.5 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.86 -51.55 54.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.046 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 21.0 m . . . . . 0 C--O 1.233 0.186 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.311 -179.915 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 48.9 t0 . . . . . 0 CA--C 1.519 -0.226 0 N-CA-C 110.427 -0.212 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.0 -33.5 75.87 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.55 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -44.15 71.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.087 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.8 m -60.33 -51.41 69.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.19 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.27 -46.39 80.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.159 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 36.7 tp -61.58 -43.35 99.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.567 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -62.41 -51.56 67.05 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.387 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mm-40 -60.87 -39.86 90.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.141 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.2 tp -61.55 -51.39 68.76 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.781 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.574 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -59.64 -38.13 80.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.299 0.571 . . . . 0.0 110.44 -177.808 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 . . . . . 0 C--N 1.315 -0.913 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.312 179.9 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 10.7 ptm . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.644 0.259 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -64.41 -37.89 89.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 0.0 110.141 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -64.15 -46.01 85.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.033 0.444 . . . . 0.0 110.066 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -55.28 -30.16 59.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.64 -178.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 150' ' ' VAL . 97.4 mttt -69.13 -43.73 73.78 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.214 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.429 ' O ' ' CB ' ' A' ' 151' ' ' LEU . 84.2 m -69.96 -36.02 74.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.537 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.4 mtt -60.27 -46.03 91.23 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.02 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.3 mp -73.25 -50.6 21.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.43 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 146' ' ' LYS . 79.1 t -60.56 -45.74 96.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.498 -178.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.429 ' CB ' ' O ' ' A' ' 147' ' ' THR . 56.6 tp -58.05 -44.72 87.58 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.496 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.87 -36.7 82.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.516 ' CG ' ' HZ3' ' A' ' 157' ' ' LYS . 38.5 tp -63.67 -42.05 98.11 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.912 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.34 -42.42 95.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.414 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.22 -40.24 96.9 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.75 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.16 -39.02 69.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.269 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . 0.516 ' HZ3' ' CG ' ' A' ' 153' ' ' LEU . 31.2 mttp -62.73 -44.68 95.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.834 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.7 -44.21 97.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.457 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 80.7 t -65.48 -43.06 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.085 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -60.15 -47.63 85.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.81 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 74.5 m -167.89 168.12 12.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.39 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -117.92 127.04 53.47 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.989 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.46 156.91 59.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.643 -179.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -69.67 157.59 60.04 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.954 2.436 . . . . 0.0 112.537 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.056 179.692 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 167' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.458 -0.075 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -59.08 -43.32 91.77 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.221 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.98 -43.28 99.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.677 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.452 ' O ' ' OG1' ' A' ' 173' ' ' THR . 96.4 t -62.88 -43.34 98.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.066 0.46 . . . . 0.0 110.221 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -56.29 -49.24 74.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -61.86 -45.35 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.544 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 19.4 p -58.37 -45.69 87.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.195 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -54.04 -45.71 71.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 110.272 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 86.0 t -61.13 -44.42 98.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.782 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.499 -179.978 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.474 0.178 . . . . 0.0 110.824 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -60.11 -45.59 92.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.245 0.545 . . . . 0.0 110.021 -179.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -57.18 -44.62 83.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.809 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -58.17 -39.7 79.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.58 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.5 t -58.43 -50.2 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.035 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -68.47 -45.84 71.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.299 0.571 . . . . 0.0 110.745 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 23.6 p -58.64 -35.07 71.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.998 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 85.3 mt . . . . . 0 N--CA 1.464 0.235 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.266 179.789 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 N--CA 1.467 0.42 0 CA-C-O 120.916 0.389 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -60.66 -31.52 70.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.952 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -66.89 -36.61 82.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.449 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -61.52 -45.27 94.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.158 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.453 ' O ' HG22 ' A' ' 86' ' ' ILE . 96.6 mt -65.08 -44.38 95.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.354 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.405 ' O ' ' HB2' ' A' ' 87' ' ' ALA . 97.2 mt -66.07 -41.11 88.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.253 0.549 . . . . 0.0 110.27 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -70.61 -50.31 38.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.851 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -52.91 -55.09 25.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.303 -178.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.535 HG23 ' N ' ' A' ' 87' ' ' ALA . 21.0 tt -63.29 -44.61 99.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.724 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.535 ' N ' HG23 ' A' ' 86' ' ' ILE . . . -51.13 -39.38 56.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.955 -178.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -65.26 -49.79 68.26 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.411 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -66.94 -52.15 46.47 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 120.337 -0.545 . . . . 0.0 109.896 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.421 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.6 tt -52.84 -38.48 61.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.114 -179.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.67 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.748 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -67.76 -46.01 73.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.854 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 96' ' ' SER . 69.3 t -66.23 -40.38 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.195 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -55.78 -42.91 86.7 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -61.69 -47.48 85.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.199 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 93' ' ' VAL . 46.7 t -109.07 110.8 22.15 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.075 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.435 ' O ' ' O ' ' A' ' 98' ' ' ASP . 10.8 ttm -64.95 -11.34 37.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.924 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.488 ' O ' ' N ' ' A' ' 100' ' ' SER . 98.8 m-20 -53.29 -167.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 51.5 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.154 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 98' ' ' ASP . 48.1 t . . . . . 0 C--N 1.329 -0.312 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 77.7 mt . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.735 0.302 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -34.56 62.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.066 0.46 . . . . 0.0 110.467 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.33 -41.6 98.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.174 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.83 -42.24 59.42 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.599 ' O ' HD23 ' A' ' 109' ' ' LEU . 3.1 tt -60.75 -48.45 81.73 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.994 0.426 . . . . 0.0 110.041 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.78 93.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.526 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.611 HD23 ' O ' ' A' ' 111' ' ' LEU . 2.9 tt -63.31 -47.56 81.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.943 0.401 . . . . 0.0 110.165 -179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.86 -39.71 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.307 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.23 -42.31 99.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.402 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -64.8 -38.08 89.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.17 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.13 -37.97 75.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.155 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.497 179.925 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 64.2 t0 . . . . . 0 N--CA 1.462 0.125 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 60.2 mt -52.01 -33.13 37.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.672 0.272 . . . . 0.0 110.577 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.41 -49.62 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.817 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 15.5 m -62.95 -42.72 99.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.334 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.46 -46.92 80.13 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.0 mt -58.93 -41.26 86.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -54.94 -52.43 63.02 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.707 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -51.98 -47.91 64.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.107 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.556 HD13 ' O ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -64.1 -42.89 96.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.512 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -56.63 -47.69 79.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.036 -178.806 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.214 -179.926 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.274 0 CA-C-O 121.01 0.433 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -66.84 -40.96 88.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.479 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -60.84 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.199 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -72.59 -52.52 15.15 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.992 -0.683 . . . . 0.0 109.289 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -52.36 -39.7 61.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.236 -179.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 70.6 m -63.64 -44.17 94.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.617 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 18.9 mtm -62.89 -38.75 92.14 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.577 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.12 -41.79 99.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.076 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 75.8 t -63.39 -42.54 96.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.623 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.82 -45.26 90.38 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.195 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.41 -31.56 72.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.306 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 10.1 tp -71.98 -41.32 67.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.896 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.994 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.46 -44.09 95.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.17 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.8 -40.67 79.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.016 0.436 . . . . 0.0 110.312 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -64.2 -42.72 96.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.045 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.29 -45.12 94.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.308 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 70.5 t -62.29 -45.81 97.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.16 -41.43 97.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.767 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 28.8 t -142.97 145.14 32.69 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.366 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 35.8 m80 -68.64 -139.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.479 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 5.3 p -140.05 150.57 62.51 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.081 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.445 ' O ' ' CB ' ' A' ' 165' ' ' SER . 44.2 Cg_exo -41.96 -64.58 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 122.232 1.955 . . . . 0.0 112.565 179.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.5 m . . . . . 0 CA--C 1.533 0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.311 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 58.0 mt . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.678 0.275 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -65.06 -42.48 94.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 0.0 110.626 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -64.87 -43.84 91.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.658 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.9 t -61.19 -45.65 98.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.097 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -57.29 -42.91 82.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.097 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -59.78 -40.57 88.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.605 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 20.1 m -59.84 -44.89 93.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -59.36 -45.93 90.04 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 110.639 -179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.09 -44.53 95.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.146 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 40.3 t30 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.541 -179.983 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.804 0.335 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -57.36 -36.88 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.5 m -59.69 -51.03 71.51 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.733 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -66.83 -39.86 87.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.113 0.482 . . . . 0.0 110.691 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.24 -39.65 83.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.332 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -61.23 -44.62 96.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.644 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 72.3 m -58.49 -38.31 77.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.361 . . . . 0.0 110.391 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 57.3 tp . . . . . 0 C--N 1.328 -0.336 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.204 179.829 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 56.2 p . . . . . 0 N--CA 1.461 0.085 0 CA-C-O 120.939 0.399 . . . . 0.0 110.683 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -47.37 -29.94 2.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.555 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -67.2 -33.87 76.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.689 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -55.72 -46.79 77.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.522 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.672 HD12 ' N ' ' A' ' 82' ' ' ILE . 2.0 mp -62.79 -46.04 97.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.357 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 97.2 mt -62.11 -43.04 97.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.684 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.3 ttt85 -50.97 -49.96 59.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.643 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -56.46 -43.85 79.95 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.632 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.89 -50.1 81.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.456 -0.497 . . . . 0.0 109.722 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.1 89.85 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -57.8 -48.5 79.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.67 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -66.75 -40.42 88.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.158 0.504 . . . . 0.0 110.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 94' ' ' GLY . 5.9 tt -66.91 -38.87 87.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.625 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.405 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -59.97 -42.02 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.628 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -65.41 -52.51 52.82 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.921 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.5 t -69.66 -26.08 29.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.815 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -85.5 -37.36 9.71 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.224 -0.75 . . . . 0.0 111.224 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.455 ' O ' ' O ' ' A' ' 96' ' ' SER . 42.7 t0 -72.05 -46.46 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.614 0.245 . . . . 0.0 110.941 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.457 ' C ' ' H ' ' A' ' 98' ' ' ASP . 70.9 m -57.62 -123.22 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.917 0.389 . . . . 0.0 111.034 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.6 ttt 62.66 1.44 0.79 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.035 0.445 . . . . 0.0 110.251 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.457 ' H ' ' C ' ' A' ' 96' ' ' SER . 43.5 t0 -62.74 -37.59 87.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.512 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -66.98 135.48 53.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.537 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 t . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.472 -179.995 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.568 HD12 ' N ' ' A' ' 105' ' ' LEU . 9.9 mp . . . . . 0 N--CA 1.464 0.25 0 CA-C-O 120.909 0.385 . . . . 0.0 110.296 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.36 -32.75 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.735 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.423 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 56.5 t-20 -60.32 -30.19 69.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.14 0.495 . . . . 0.0 110.518 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -64.42 -47.72 81.38 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.631 ' N ' HD22 ' A' ' 109' ' ' LEU . 3.5 mm? -62.91 -38.52 91.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.719 0.295 . . . . 0.0 110.708 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.99 73.31 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.236 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.608 HD23 ' O ' ' A' ' 111' ' ' LEU . 2.6 tt -70.63 -48.09 56.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -61.79 -25.49 67.51 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.689 -179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.41 ' N ' ' O ' ' A' ' 109' ' ' LEU . 58.6 tp -60.22 -43.11 96.27 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.17 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.59 -42.64 98.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.576 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -65.46 -43.37 90.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.686 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.9 m . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.66 179.794 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.1 t0 . . . . . 0 CA--C 1.522 -0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.3 pp -50.76 -32.22 19.13 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.983 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.76 -48.24 69.91 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.972 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 8.4 m -60.2 -38.6 83.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.085 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -47.55 78.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.15 -44.43 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.479 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.86 -51.03 68.6 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.891 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -54.82 -37.88 66.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.598 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.8 tp -60.04 -51.14 70.92 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.28 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.11 -44.22 97.68 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.3 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 . . . . . 0 C--N 1.325 -0.496 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.595 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.3 mtt . . . . . 0 N--CA 1.462 0.149 0 CA-C-O 120.798 0.332 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -59.99 -42.52 94.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.415 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.31 -33.54 73.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.654 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -70.2 -44.2 69.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.375 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.4 ' O ' HG23 ' A' ' 150' ' ' VAL . 53.7 mtmt -66.5 -39.46 88.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.736 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 72.5 m -59.7 -43.3 94.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.444 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 49.2 mtt -61.15 -45.97 92.45 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.152 -179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.33 -50.36 33.16 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.516 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 146' ' ' LYS . 71.0 t -58.73 -43.41 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.095 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.37 -45.92 90.11 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.48 82.39 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.916 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.61 -39.93 77.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.452 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.41 -41.72 90.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.61 -44.61 95.87 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.017 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.78 78.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.998 0.428 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 161' ' ' SER . 0.9 OUTLIER -60.27 -45.71 92.36 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.858 -179.244 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.55 -37.71 87.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.588 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 97.2 t -69.11 -51.72 40.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . 0.692 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -72.53 -50.54 25.01 Favored 'General case' 0 C--O 1.218 -0.578 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.184 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . 0.502 ' N ' ' O ' ' A' ' 157' ' ' LYS . 78.2 p 24.18 35.02 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.171 0.51 . . . . 0.0 111.165 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . 0.692 ' N ' ' O ' ' A' ' 160' ' ' ALA . 5.7 p80 -155.98 137.99 14.52 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.389 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.1 m -162.62 128.22 2.22 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.22 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -44.16 -31.38 4.08 Favored 'Trans proline' 0 N--CA 1.49 1.306 0 C-N-CA 121.85 1.7 . . . . 0.0 112.409 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . 0.507 ' O ' ' N ' ' A' ' 167' ' ' LEU . 1.1 m . . . . . 0 C--N 1.331 -0.198 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' A' ' 165' ' ' SER . 85.5 mt . . . . . 0 N--CA 1.456 -0.14 0 CA-C-O 121.101 0.477 . . . . 0.0 110.234 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.43 -42.04 79.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.046 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -60.7 -47.09 87.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.081 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.422 HG23 ' N ' ' A' ' 171' ' ' PHE . 27.8 m -70.71 -40.04 76.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.657 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . 0.45 ' O ' HG23 ' A' ' 175' ' ' VAL . 86.3 t80 -58.53 -45.41 88.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.52 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -47.13 79.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.665 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.88 -39.9 91.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.611 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 71.2 m -60.41 -44.6 95.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.876 0.369 . . . . 0.0 110.443 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 171' ' ' PHE . 73.0 t -63.72 -40.6 89.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.549 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 7.1 m120 . . . . . 0 C--N 1.326 -0.43 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.269 -179.707 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' ' 182' ' ' LEU . 4.1 mm? . . . . . 0 C--O 1.223 -0.32 0 CA-C-O 120.589 0.233 . . . . 0.0 110.551 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 64.0 ttm-85 -51.89 -42.29 62.59 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.726 -179.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.4 m -61.44 -52.3 65.13 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.689 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.64 -40.81 76.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.83 0.348 . . . . 0.0 110.808 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.72 -43.77 96.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.316 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.0 ttp85 -59.72 -53.04 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.613 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 21.4 m -63.22 -40.43 97.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 49.9 tp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.561 -179.356 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.464 0.245 0 CA-C-O 120.757 0.313 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -66.06 -20.76 66.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.592 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.15 -38.7 80.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.459 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.65 -46.91 86.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.815 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.13 -43.75 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 -179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.74 -42.85 97.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -54.89 -47.32 74.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.658 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -62.02 -43.17 99.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.029 0.442 . . . . 0.0 110.516 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.7 mt -59.51 -44.25 92.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.72 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.74 -40.95 98.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.02 0.438 . . . . 0.0 110.243 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -54.65 -45.34 73.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.532 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -65.02 -41.45 95.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.603 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 94' ' ' GLY . 9.5 mt -66.43 -39.56 89.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.479 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.62 -46.46 77.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.184 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -61.68 -52.14 65.53 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.028 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.02 -25.84 36.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.7 -29.15 24.67 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.446 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.7 t70 -61.34 -45.84 92.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.785 0.326 . . . . 0.0 110.727 -179.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 90.0 p -136.45 104.91 5.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.934 0.397 . . . . 0.0 110.466 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 39.1 ttp -127.35 -16.86 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.373 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -64.9 -31.5 72.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.575 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -65.09 -40.4 94.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.186 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.943 -179.461 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.871 0.367 . . . . 0.0 110.31 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 12.2 p -59.53 -32.9 50.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.532 -179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.9 -44.72 96.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.89 -41.09 91.34 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.76 -44.31 96.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.145 0.498 . . . . 0.0 110.401 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.04 93.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.61 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.402 ' O ' ' N ' ' A' ' 115' ' ' ASN . 63.7 mt -63.28 -41.49 99.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.628 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . 0.471 ' O ' HG22 ' A' ' 116' ' ' THR . 85.4 mm-40 -58.18 -47.34 83.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.455 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 64.6 tp -68.73 -43.46 75.87 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 121.544 0.688 . . . . 0.0 110.31 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.56 -37.52 86.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.216 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 111' ' ' LEU . 40.0 t30 -63.9 -44.35 93.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.028 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 112' ' ' GLN . 10.0 t . . . . . 0 C--N 1.332 -0.192 0 CA-C-O 120.793 0.33 . . . . 0.0 110.416 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.1 t0 . . . . . 0 C--O 1.232 0.151 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 65.9 mt -54.49 -31.44 55.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.714 0.292 . . . . 0.0 110.671 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.16 -47.06 75.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.421 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 23.4 m -63.68 -44.21 94.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.9 -47.74 81.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.615 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.95 -41.16 95.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.415 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -61.7 -48.88 78.77 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.98 -44.61 95.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.658 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.78 -53.32 57.57 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.306 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.568 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -59.68 -38.92 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.463 -0.495 . . . . 0.0 109.857 -178.112 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 . . . . . 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.624 179.809 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 30.5 ttm . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.831 0.348 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 147' ' ' THR . 22.6 pt-20 -53.87 -35.32 61.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.197 0.522 . . . . 0.0 110.718 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . 0.488 ' O ' ' OG1' ' A' ' 147' ' ' THR . 47.1 tttp -64.16 -34.82 78.96 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.281 0.563 . . . . 0.0 111.147 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.78 -48.9 65.04 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.773 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.452 ' O ' HG23 ' A' ' 150' ' ' VAL . 46.4 pttt -70.31 -31.69 69.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.004 0.43 . . . . 0.0 110.367 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . 0.811 HG23 ' O ' ' A' ' 143' ' ' GLU . 12.2 p -60.11 -45.92 91.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.032 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mtm -62.49 -46.06 90.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.059 179.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . 0.419 HD22 ' N ' ' A' ' 149' ' ' LEU . 4.2 mm? -65.35 -47.41 76.55 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 119.591 -0.844 . . . . 0.0 110.256 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 146' ' ' LYS . 45.7 t -60.89 -41.08 87.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.561 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.1 tp -57.79 -45.21 86.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.629 -179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.01 -41.26 95.52 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.613 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.69 -43.51 98.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.607 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.9 mt -60.78 -43.54 97.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.161 0.505 . . . . 0.0 110.031 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.541 ' O ' HD13 ' A' ' 155' ' ' LEU . 0.2 OUTLIER -62.56 -44.48 96.24 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.685 -179.552 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.73 -35.99 75.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.495 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.14 -48.85 79.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.453 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -64.0 -40.72 97.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.916 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 155' ' ' LEU . 76.9 t -66.32 -46.11 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.931 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -66.06 -36.06 82.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.962 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.6 p -159.17 162.92 36.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.548 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -88.87 -161.61 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 12.9 p -84.95 147.84 49.26 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.973 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -41.48 -71.79 0.05 OUTLIER 'Trans proline' 0 N--CA 1.49 1.31 0 C-N-CA 122.284 1.99 . . . . 0.0 112.456 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 4.9 t . . . . . 0 CA--C 1.532 0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.997 -179.4 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.552 ' N ' HD12 ' A' ' 167' ' ' LEU . 10.4 mp . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 121.066 0.46 . . . . 0.0 110.123 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -59.93 -41.99 92.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.698 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -68.25 -46.37 70.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.124 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.08 -45.94 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.473 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -60.05 -39.31 85.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.371 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.51 -49.25 78.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.348 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 23.8 m -61.07 -46.86 88.93 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.062 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.3 m -52.66 -42.42 64.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.125 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.4 -44.34 99.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.773 0.321 . . . . 0.0 110.688 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 179.469 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.48 ' O ' HG23 ' A' ' 186' ' ' VAL . 56.6 mt . . . . . 0 C--O 1.223 -0.29 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -51.32 -45.78 62.36 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.965 -178.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.1 m -62.63 -51.29 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.121 0.486 . . . . 0.0 110.008 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -62.08 -40.33 95.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.203 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 182' ' ' LEU . 42.0 t -62.7 -44.2 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.616 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 67.2 mmt-85 -58.05 -53.62 56.23 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.148 -178.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 69.1 m -58.56 -40.92 84.42 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.497 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 84.8 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.386 -179.911 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.78 0.324 . . . . 0.0 110.428 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.49 -34.54 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.406 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -60.13 -39.51 86.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.325 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -62.12 -46.16 90.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.445 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.69 -43.73 93.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.604 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.2 mt -60.69 -41.73 89.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -58.36 -55.05 40.03 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.803 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -52.86 -52.25 57.99 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.668 -178.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.59 -51.21 73.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.043 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -57.36 -36.86 71.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.26 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -61.87 -45.91 91.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.526 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -66.02 -43.29 88.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.931 0.396 . . . . 0.0 110.14 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.558 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.8 mp -71.42 -33.69 69.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.048 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.486 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -56.9 -48.43 78.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.439 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -72.18 -52.54 16.07 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.906 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 88.3 t -66.68 -26.33 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 121.039 0.447 . . . . 0.0 110.745 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -75.97 -37.04 39.51 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.13 -47.6 79.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.495 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.3 p -106.16 106.67 17.29 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 110.383 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.462 ' O ' ' SD ' ' A' ' 97' ' ' MET . 2.3 tmm? -171.0 -32.6 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 98' ' ' ASP . 35.5 p-10 -65.67 -22.87 66.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.956 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -60.5 -38.57 84.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.7 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.621 179.771 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.0 mt . . . . . 0 C--O 1.232 0.142 0 CA-C-O 121.007 0.432 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.45 ' H ' HG22 ' A' ' 106' ' ' VAL . 3.2 m -66.44 -37.74 80.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.71 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -62.43 -41.31 98.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 0.0 110.194 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -67.89 -48.72 53.11 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.34 -41.47 98.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.142 0.496 . . . . 0.0 110.335 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.46 -48.44 74.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.337 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.73 -43.11 97.49 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.615 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -61.78 -34.93 76.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.728 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 113' ' ' LEU . 40.0 mt -62.73 -42.68 99.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.31 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -78.12 -20.75 51.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.169 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -62.73 -34.79 77.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.307 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.2 m . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.656 -179.408 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 47.2 t0 . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.305 0.098 . . . . 0.0 110.739 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.7 mt -65.4 -34.71 78.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.729 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.42 -44.68 72.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.6 m -63.73 -46.56 84.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.401 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.19 -43.45 95.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.771 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 81.2 mt -61.64 -43.6 98.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.79 0.329 . . . . 0.0 110.22 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -68.65 -46.42 69.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.288 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -62.02 -51.49 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.748 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.5 tp -63.7 -47.9 79.29 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.855 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.33 -28.54 66.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.898 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.169 -178.195 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 36.2 ttm . . . . . 0 N--CA 1.467 0.377 0 CA-C-O 120.791 0.329 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -66.32 -35.35 80.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.566 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 20.6 tptt -60.58 -34.06 73.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.146 0.498 . . . . 0.0 110.457 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -76.56 -35.92 57.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.529 178.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -68.54 -47.13 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.555 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 73.3 m -61.92 -42.63 99.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.116 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 48.5 tpp -54.76 -46.25 74.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.97 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 94.6 mt -70.06 -46.71 64.39 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.724 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 76.3 t -60.05 -44.75 95.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.542 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.2 tt -61.46 -44.82 96.42 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.042 0.449 . . . . 0.0 110.866 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.48 89.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 43.1 tp -58.46 -40.77 83.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.187 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.46 -43.87 96.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.251 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 96.7 mt -65.48 -46.57 79.24 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.318 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.24 -40.39 90.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.095 0.474 . . . . 0.0 110.194 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 161' ' ' SER . 19.3 tptm -64.49 -35.33 80.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.719 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.24 -40.31 95.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.322 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 57.8 t -75.85 -50.24 23.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.865 179.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . 0.65 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -67.69 -50.1 59.38 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.814 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 160' ' ' ALA . 66.8 m 25.12 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.739 0.649 . . . . 0.0 111.487 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . 0.65 ' N ' ' O ' ' A' ' 160' ' ' ALA . 90.0 m-70 -147.88 120.58 8.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.285 -177.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.37 175.57 2.65 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.319 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -57.23 -153.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.473 2.115 . . . . 0.0 111.753 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.416 179.571 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 47.5 mt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.747 0.308 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -59.74 -44.94 93.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.577 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -64.45 -44.12 92.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.95 0.405 . . . . 0.0 110.709 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 92.9 t -64.42 -44.16 97.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.786 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -59.92 -42.18 93.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.419 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.9 -49.3 78.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.493 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.8 m -59.41 -46.19 89.4 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.058 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.6 m -52.57 -44.99 66.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.825 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 75.0 t -58.93 -41.69 83.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.078 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . 0.403 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 55.5 t-20 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 63.1 tp . . . . . 0 N--CA 1.456 -0.128 0 CA-C-O 120.628 0.251 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -60.51 -38.33 84.01 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.531 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 72.5 m -59.14 -44.95 92.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.229 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -61.84 -39.63 92.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.452 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.4 t -60.67 -48.72 87.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.513 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -63.82 -32.79 74.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.27 0.557 . . . . 0.0 110.687 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 16.3 m -57.34 -33.21 67.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.287 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.452 ' N ' HD22 ' A' ' 189' ' ' LEU . 4.1 mm? . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.525 179.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 p . . . . . 0 N--CA 1.468 0.428 0 CA-C-O 120.761 0.315 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -61.97 -43.24 99.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.489 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -67.33 -33.77 75.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.506 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -60.5 -37.38 80.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.603 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 93.6 mt -62.7 -44.36 99.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.38 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.6 mt -63.79 -44.7 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -55.59 -43.89 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.857 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.458 ' OD1' ' CD2' ' A' ' 89' ' ' HIS . 45.9 t-20 -63.97 -42.52 97.21 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.003 0.43 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.7 mt -60.3 -44.49 95.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.111 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.6 -50.34 73.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.963 0.411 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 94.1 mtm-85 -54.07 -45.95 71.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.458 ' CD2' ' OD1' ' A' ' 85' ' ' ASN . 36.1 m-70 -66.93 -41.82 86.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.075 0.464 . . . . 0.0 110.221 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.693 ' O ' HD23 ' A' ' 90' ' ' LEU . 3.2 tt -64.58 -41.7 96.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.099 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.17 82.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.396 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -65.24 -52.21 55.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.423 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.8 t -71.39 -26.4 26.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.045 0.45 . . . . 0.0 110.657 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -79.91 -40.73 13.73 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.45 -47.08 77.41 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.663 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.0 p -75.0 -31.24 61.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 54.92 -170.54 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.257 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.641 ' C ' ' H ' ' A' ' 100' ' ' SER . 51.7 t0 -86.35 2.25 48.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 60.66 -10.4 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.654 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.641 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.9 m . . . . . 0 N--CA 1.451 -0.416 0 CA-C-O 120.952 0.406 . . . . 0.0 110.08 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.534 HD12 ' N ' ' A' ' 105' ' ' LEU . 10.3 mp . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.874 0.368 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 107' ' ' ASN . 12.6 p -50.48 -36.32 13.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.399 -178.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.432 ' N ' HG13 ' A' ' 106' ' ' VAL . 98.5 m-20 -61.25 -40.07 92.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.871 0.367 . . . . 0.0 110.159 179.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.05 -39.89 81.08 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 109' ' ' LEU . 9.6 mp -63.58 -42.78 98.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.519 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -39.02 86.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.9 -39.8 95.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.358 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -57.98 -47.74 82.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.761 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.79 -21.83 63.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.618 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -87.73 -55.49 3.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.587 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 32.8 m . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.722 -179.584 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 63.8 t0 . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 120.595 0.236 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.6 mt -51.48 -35.76 41.37 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.98 70.15 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.225 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 99.7 m -63.29 -42.12 99.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.105 179.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.01 80.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.15 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.96 -42.37 93.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.825 0.345 . . . . 0.0 110.339 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -63.94 -49.96 70.54 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.232 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.82 -36.45 83.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.498 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.62 -55.04 39.4 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.445 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.27 -31.65 70.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.977 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 . . . . . 0 C--N 1.318 -0.78 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.112 -179.887 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 47.9 ttp . . . . . 0 N--CA 1.464 0.238 0 CA-C-O 120.755 0.312 . . . . 0.0 110.542 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -65.26 -44.6 87.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -61.57 -49.58 76.08 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.784 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.44 -35.24 65.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.757 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -69.17 -49.85 52.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.209 0.528 . . . . 0.0 110.884 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 54.4 m -71.0 -41.21 71.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.762 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 53.1 ttm -52.88 -46.17 67.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 75.8 mt -63.91 -49.77 71.36 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.292 179.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.24 -45.06 99.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.56 HD13 ' O ' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -61.99 -46.68 88.17 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.184 0.516 . . . . 0.0 110.321 -179.293 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -59.03 -41.27 87.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.146 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 49.1 tp -59.75 -41.66 91.47 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.334 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.58 -42.86 97.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.004 0.43 . . . . 0.0 110.223 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.73 -46.53 87.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.205 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.17 -37.21 78.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . 0.699 ' HZ1' HH12 ' A' ' 168' ' ' ARG . 88.6 tttt -62.29 -45.03 95.08 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.563 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -63.03 -38.09 89.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.5 t -66.33 -44.79 90.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.569 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.78 81.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.362 -179.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 37.7 m -171.1 173.49 5.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . 0.584 ' ND1' ' N ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER 179.25 69.08 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 84.7 m -116.87 81.7 12.37 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.42 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . 0.436 ' O ' ' CB ' ' A' ' 165' ' ' SER . 73.0 Cg_endo -82.04 -179.44 4.76 Favored 'Trans proline' 0 C--N 1.312 -1.361 0 C-N-CA 122.681 2.254 . . . . 0.0 111.872 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 179.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.696 HD23 ' N ' ' A' ' 167' ' ' LEU . 2.0 pt? . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 121.217 0.532 . . . . 0.0 110.317 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.699 HH12 ' HZ1' ' A' ' 157' ' ' LYS . 55.5 mtp85 -72.18 -40.85 67.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.893 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.03 -47.05 84.7 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.989 0.423 . . . . 0.0 111.275 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.435 HG13 ' N ' ' A' ' 171' ' ' PHE . 5.8 p -65.41 -41.36 90.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.235 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . 0.435 ' N ' HG13 ' A' ' 170' ' ' VAL . 76.7 t80 -61.59 -40.9 96.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.356 179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -58.21 -47.97 81.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.353 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.7 m -58.46 -42.5 87.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.896 0.379 . . . . 0.0 110.434 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 72.3 m -57.32 -42.71 82.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.081 0.467 . . . . 0.0 110.305 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.06 -40.95 84.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.359 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 120.955 0.407 . . . . 0.0 110.384 -179.882 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.572 HD13 ' O ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.225 0 CA-C-O 121.299 0.571 . . . . 0.0 110.2 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.75 -47.28 80.42 Favored 'General case' 0 C--N 1.321 -0.63 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.137 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.4 m -59.2 -43.72 92.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.089 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.2 -38.97 84.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.56 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -59.75 -49.6 83.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.082 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 91.3 mtt-85 -68.46 -52.33 33.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 74.6 m -57.84 -37.04 73.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.115 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.531 ' C ' HD23 ' A' ' 189' ' ' LEU . 3.2 tt . . . . . 0 C--N 1.332 -0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.085 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.609 0.242 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -45.36 -36.39 4.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -179.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.99 -43.38 98.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.058 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.66 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.005 0.431 . . . . 0.0 110.315 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 86' ' ' ILE . 36.2 mm -63.2 -43.05 98.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.521 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.61 -43.75 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.107 0.479 . . . . 0.0 110.227 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.5 ttm-85 -70.58 -55.15 9.51 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.683 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -52.99 -50.52 64.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.088 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.508 HG23 ' N ' ' A' ' 87' ' ' ALA . 4.0 tp -65.12 -45.74 93.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.034 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.508 ' N ' HG23 ' A' ' 86' ' ' ILE . . . -62.63 -36.53 83.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.444 -179.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -59.94 -48.65 80.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.572 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -66.58 -40.04 88.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.204 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 93' ' ' VAL . 82.0 mt -67.52 -35.06 78.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.891 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.5 -48.27 75.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.239 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -65.87 -52.8 47.13 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.124 -0.63 . . . . 0.0 110.573 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 90' ' ' LEU . 3.4 p -66.29 -26.47 38.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.628 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.93 -27.3 29.17 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -73.58 -47.38 41.01 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.798 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.0 m -71.02 -5.04 28.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.862 0.363 . . . . 0.0 110.766 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.2 ttt -62.4 -38.53 90.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -65.43 -33.33 75.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.4 ttt85 -55.58 -44.61 77.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.487 -179.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.6 m . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.167 179.687 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.532 ' N ' HD12 ' A' ' 105' ' ' LEU . 10.9 mp . . . . . 0 N--CA 1.461 0.124 0 CA-C-O 120.736 0.303 . . . . 0.0 110.578 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.553 HG13 ' N ' ' A' ' 107' ' ' ASN . 7.3 p -68.44 -47.04 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.724 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.553 ' N ' HG13 ' A' ' 106' ' ' VAL . 13.5 m120 -68.98 -35.73 77.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.717 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -57.84 -15.94 22.11 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.83 -47.9 78.96 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.824 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.6 -38.54 80.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.5 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.81 -39.36 94.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.824 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.89 -47.74 76.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.65 -179.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.483 ' C ' ' N ' ' A' ' 115' ' ' ASN . 4.0 mm? -68.56 -42.31 78.52 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.374 179.155 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -47.7 -14.59 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.075 0.464 . . . . 0.0 110.481 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.483 ' N ' ' C ' ' A' ' 113' ' ' LEU . 10.0 m120 -61.17 -40.72 94.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.395 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 t . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 121.13 0.491 . . . . 0.0 110.714 179.68 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 CA--C 1.521 -0.162 0 CA-C-O 120.465 0.174 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 58.0 mt -62.13 -35.76 79.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 120.639 0.256 . . . . 0.0 110.826 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -43.91 71.4 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.092 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.9 m -63.32 -47.66 81.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.239 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.58 -47.66 85.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.283 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.05 -40.44 97.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.446 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.47 -50.63 73.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.524 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -57.42 -44.7 84.87 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.702 -0.399 . . . . 0.0 109.962 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.91 -48.99 77.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.76 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.567 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.28 -42.2 86.04 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.94 -178.338 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 . . . . . 0 C--N 1.322 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.98 179.638 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 5.8 ptp . . . . . 0 N--CA 1.461 0.082 0 CA-C-O 120.928 0.394 . . . . 0.0 110.031 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -64.02 -49.34 72.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.443 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -65.85 -40.76 92.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.67 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.81 -35.3 76.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.417 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 150' ' ' VAL . 38.1 ttmt -72.02 -35.82 69.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.912 0.387 . . . . 0.0 110.45 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 77.4 m -59.74 -44.06 93.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.025 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 51.0 mtt -61.04 -45.33 95.2 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.492 -0.483 . . . . 0.0 109.737 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.72 -43.14 94.38 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.702 179.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 146' ' ' LYS . 47.3 t -62.1 -43.25 97.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.528 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.28 -44.42 88.46 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.315 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.47 90.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.004 0.43 . . . . 0.0 110.493 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 18.9 tp -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.448 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -47.81 84.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.453 . . . . 0.0 110.253 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.0 tp -67.14 -45.27 77.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.272 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.22 87.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.618 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.0 -37.81 83.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.286 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -62.54 -43.08 99.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.125 0.488 . . . . 0.0 110.509 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.8 t -67.15 -43.83 88.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.335 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.69 -35.63 80.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.897 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 29.5 m -159.84 161.99 34.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.379 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -98.56 -26.19 14.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.736 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 4.3 p 64.04 145.19 0.08 OUTLIER Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.494 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -71.67 155.66 58.5 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.466 2.111 . . . . 0.0 111.943 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . 0.469 ' O ' ' N ' ' A' ' 167' ' ' LEU . 8.7 t . . . . . 0 C--N 1.328 -0.333 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.469 ' N ' ' O ' ' A' ' 165' ' ' SER . 53.7 mt . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 121.027 0.442 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -64.4 -45.83 85.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.553 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -66.12 -43.67 86.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.478 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 82.8 t -63.93 -44.94 98.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.348 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -61.0 -41.34 96.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.45 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -63.45 -49.68 72.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.815 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 16.4 m -61.74 -42.6 99.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.806 0.336 . . . . 0.0 110.432 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.7 m -53.87 -44.09 70.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.585 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.4 t -64.29 -42.12 94.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.807 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 46.3 t30 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.267 179.642 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.431 ' O ' HG12 ' A' ' 186' ' ' VAL . 55.5 mt . . . . . 0 N--CA 1.453 -0.323 0 CA-C-O 120.507 0.194 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -51.0 -42.15 60.17 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.154 -177.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 85.5 m -72.36 -51.49 20.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.793 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -63.68 -49.35 73.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.385 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . 0.431 HG12 ' O ' ' A' ' 182' ' ' LEU . 3.0 p -58.41 -35.01 52.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.148 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 59.5 ttt85 -59.68 -52.28 66.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.903 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 78.2 p -58.73 -48.71 80.22 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.694 -179.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 10.9 mp . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.525 179.582 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.6 t . . . . . 0 N--CA 1.457 -0.111 0 CA-C-O 120.903 0.382 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -65.06 -30.49 71.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.772 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -38.84 82.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.538 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -63.05 -42.36 99.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.464 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.59 -44.78 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.415 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.4 mt -63.22 -43.66 98.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.92 0.391 . . . . 0.0 110.179 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.414 ' HG2' ' HE ' ' A' ' 88' ' ' ARG . 44.8 ttm180 -52.58 -54.42 33.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.825 -179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.526 ' ND2' ' NE2' ' A' ' 89' ' ' HIS . 14.9 t-20 -57.51 -40.94 79.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 110.672 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.4 mt -60.24 -52.87 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.277 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.54 72.69 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.117 0.484 . . . . 0.0 110.478 -179.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . 0.414 ' HE ' ' HG2' ' A' ' 84' ' ' ARG . 93.9 mtt-85 -61.08 -44.38 97.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.474 179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.526 ' NE2' ' ND2' ' A' ' 85' ' ' ASN . 77.7 m-70 -66.38 -44.03 84.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.934 0.397 . . . . 0.0 110.648 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.3 mp -69.23 -35.09 75.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.572 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.52 -47.96 83.51 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.596 -179.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -67.79 -52.44 37.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.344 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.4 t -66.86 -27.22 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.561 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -65.83 -39.55 95.15 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.42 -44.89 95.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.893 0.377 . . . . 0.0 110.632 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.455 ' C ' ' N ' ' A' ' 98' ' ' ASP . 68.9 m -77.32 -3.44 39.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.73 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.4 ttm -49.79 -13.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.455 ' N ' ' C ' ' A' ' 96' ' ' SER . 88.9 m-20 -66.18 -11.25 48.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.505 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -73.51 -66.04 0.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.612 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 72.1 m . . . . . 0 CA--C 1.515 -0.397 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.47 179.977 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.272 0 CA-C-O 121.179 0.514 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.411 ' H ' HG22 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -70.34 -44.57 77.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.024 179.157 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 56.5 t-20 -57.01 -50.0 74.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.348 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -70.42 -46.56 48.01 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.427 ' O ' ' N ' ' A' ' 113' ' ' LEU . 47.2 tp -52.18 -47.75 65.37 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.929 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.32 74.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.275 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.414 ' O ' ' N ' ' A' ' 115' ' ' ASN . 82.4 mt -67.48 -46.88 71.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.005 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -64.4 -33.39 75.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.228 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 109' ' ' LEU . 53.6 tp -66.54 -39.26 88.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.945 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -91.17 -21.89 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.884 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 111' ' ' LEU . 96.7 m-20 -88.67 4.0 48.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 54.0 m . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.988 179.742 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.555 0.217 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.5 mt -67.48 -43.56 80.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.804 0.335 . . . . 0.0 110.93 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.02 -32.78 74.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.436 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 21.4 m -62.33 -52.66 62.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.324 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.53 88.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.33 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.7 tp -62.0 -48.69 79.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.25 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -59.33 -35.02 73.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.239 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -63.63 -40.48 97.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.594 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.0 tp -62.13 -44.34 96.85 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.619 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 135' ' ' LEU . 9.7 mp -74.83 -32.41 61.93 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.658 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 -179.26 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 74.6 mtm . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 120.768 0.318 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.517 ' OE1' ' N ' ' A' ' 144' ' ' LYS . 7.1 tm-20 -70.71 -47.0 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' LYS . . . . . 0.517 ' N ' ' OE1' ' A' ' 143' ' ' GLU . 10.4 tptm -62.71 -48.42 79.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.841 -179.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.54 -50.78 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.355 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' LYS . . . . . 0.416 ' O ' HG23 ' A' ' 150' ' ' VAL . 55.3 mtpt -63.48 -39.06 93.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.533 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 74.9 m -59.89 -46.86 88.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.567 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.6 mtm -64.58 -41.9 95.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.585 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 78.0 mt -63.69 -44.26 94.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.968 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 146' ' ' LYS . 72.4 t -66.93 -43.14 89.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.432 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 55.4 tp -59.11 -46.6 87.89 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.474 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.6 -38.81 90.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.263 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.7 tp -63.68 -41.26 98.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.463 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 64.8 mt -60.22 -43.09 96.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.208 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.35 -41.84 98.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.242 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.87 -33.45 70.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.256 0.551 . . . . 0.0 110.502 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -72.46 -44.2 62.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.343 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.06 -48.2 77.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.489 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 160' ' ' ALA . 14.9 p -62.18 -36.84 76.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.249 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -60.97 -51.35 69.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.625 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 23.7 p -24.14 141.47 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.793 0.683 . . . . 0.0 110.684 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' HIS . . . . . 0.57 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.5 m-70 168.51 -38.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.36 156.68 75.97 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.384 -179.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.98 144.61 88.29 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.61 2.206 . . . . 0.0 111.713 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 85.0 p . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 179.655 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 54.3 tp . . . . . 0 N--CA 1.454 -0.234 0 CA-C-O 120.793 0.33 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -65.39 -39.42 92.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.628 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' ASP . . . . . 0.449 ' O ' HG23 ' A' ' 173' ' ' THR . 99.7 m-20 -62.88 -46.63 86.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.997 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.477 ' O ' ' OG1' ' A' ' 173' ' ' THR . 77.1 t -64.3 -44.28 97.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.228 0.537 . . . . 0.0 110.17 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -57.62 -45.56 85.23 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.238 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -65.51 -41.88 92.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.86 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 18.6 p -58.82 -46.59 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.325 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.42 -43.96 88.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.029 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.9 t -59.71 -43.4 91.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.193 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 13.1 m120 . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.655 -179.586 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 182' ' ' LEU . . . . . 0.524 HD22 ' N ' ' A' ' 182' ' ' LEU . 4.1 mm? . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.741 0.305 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 183' ' ' ARG . . . . . 0.583 HH12 ' NH1' ' A' ' 187' ' ' ARG . 73.8 ttt-85 -53.82 -41.37 67.27 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.379 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -60.29 -51.98 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.644 -179.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -67.92 -39.57 83.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.745 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.08 -42.47 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.705 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 187' ' ' ARG . . . . . 0.583 ' NH1' HH12 ' A' ' 183' ' ' ARG . 62.3 ttp180 -60.28 -45.23 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.773 -179.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 36.2 t -58.89 -51.22 70.96 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.762 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 189' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 189' ' ' LEU . 4.0 mm? . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.674 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -89.9 -0.67 57.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.776 0.322 . . . . 0.0 110.431 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.515 ' O ' ' N ' ' A' ' 65' ' ' SER . 60.0 ttm-85 -64.04 -42.72 96.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.199 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 65' ' ' SER . 31.6 t 49.11 -87.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.674 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 63' ' ' ARG . 8.4 p 59.76 134.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.885 0.374 . . . . 0.0 110.566 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -100.62 108.91 20.93 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.417 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.2 p -136.86 3.65 2.72 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.516 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -80.78 42.51 0.63 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.741 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 85.4 mt -62.99 -41.92 99.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.194 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 67.16 -174.54 26.25 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.971 -0.852 . . . . 0.0 110.971 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -83.03 143.19 30.78 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.523 ' O ' ' N ' ' A' ' 74' ' ' ALA . 9.9 tp -134.71 136.6 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 CA-C-O 121.001 0.429 . . . . 0.0 110.275 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -41.49 90.8 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.798 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.523 ' N ' ' O ' ' A' ' 72' ' ' ILE . . . -175.21 -31.46 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.71 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -92.37 11.92 24.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.784 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.6 t -59.03 -43.23 91.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.555 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -59.84 135.82 57.81 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 2.2 m 60.38 86.5 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.44 . . . . 0.0 109.953 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -58.88 -30.97 68.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.341 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -63.82 -35.15 79.68 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.195 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.7 t0 -62.78 -34.42 77.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.2 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.47 -43.76 98.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.349 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.87 -44.12 98.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -58.06 -44.51 87.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.112 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -63.96 -44.49 92.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 0.0 109.98 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.2 mt -61.58 -42.31 93.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.569 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.84 -51.49 68.79 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -52.31 -44.12 64.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.327 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -60.61 -50.75 72.25 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.51 -0.476 . . . . 0.0 109.99 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.549 ' O ' ' N ' ' A' ' 94' ' ' GLY . 11.7 mt -57.81 -38.32 75.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.974 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.81 74.13 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -57.52 -50.95 71.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.198 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.2 t -71.42 -26.23 26.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 121.229 0.538 . . . . 0.0 110.483 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.14 -28.57 68.06 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.216 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 98' ' ' ASP . 92.6 m-20 -68.79 -37.86 79.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.746 0.308 . . . . 0.0 111.139 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.1 t -71.25 -12.76 61.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.513 -179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 89.8 mmm -71.46 -10.42 59.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.732 0.301 . . . . 0.0 110.974 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' A' ' 95' ' ' ASP . 42.1 p-10 -98.59 8.52 44.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.731 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -155.79 38.44 0.37 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.918 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 56.7 p -144.22 -24.48 0.54 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.869 0.366 . . . . 0.0 110.431 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.625 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 0.8 OUTLIER -94.96 -37.02 0.29 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.71 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.625 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 44.0 Cg_endo -85.5 163.2 10.99 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 C-N-CA 122.167 1.911 . . . . 0.0 112.81 -178.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.24 -40.07 78.71 Favored 'Trans proline' 0 N--CA 1.494 1.5 0 C-N-CA 122.099 1.866 . . . . 0.0 111.396 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.52 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . 125.21 149.57 7.56 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.563 -1.015 . . . . 0.0 110.563 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.731 HD12 ' N ' ' A' ' 105' ' ' LEU . 6.3 mp 54.93 3.45 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.729 0.3 . . . . 0.0 111.046 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.52 ' H ' ' C ' ' A' ' 104' ' ' GLY . 7.2 p -60.17 -33.74 54.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.607 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 52.6 t-20 -69.15 -50.14 50.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.107 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.89 -48.89 18.27 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.23 -44.15 96.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.808 0.337 . . . . 0.0 110.262 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.41 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.553 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.5 tp -66.27 -44.69 82.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.99 0.424 . . . . 0.0 110.55 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -67.62 -35.04 78.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.467 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.1 tp -60.78 -42.69 98.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.59 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -65.88 -39.29 90.54 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.746 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -62.83 -44.68 95.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.582 -179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 97.3 m -66.26 -46.25 77.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.023 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.499 ' O ' ' N ' ' A' ' 119' ' ' SER . 23.2 t -86.34 16.98 3.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.689 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -64.54 70.27 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.351 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.499 ' N ' ' O ' ' A' ' 117' ' ' SER . 54.6 p -136.83 4.9 2.82 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.539 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.408 ' O ' ' O ' ' A' ' 121' ' ' GLU . 97.6 mt-10 -141.16 -158.98 0.91 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.185 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.506 ' C ' ' H ' ' A' ' 123' ' ' ARG . 97.7 mt-10 55.58 165.86 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.189 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.0 t0 69.34 -38.49 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.697 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.506 ' H ' ' C ' ' A' ' 121' ' ' GLU . 78.3 mtp85 -63.55 -41.11 98.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.742 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.495 ' OD1' ' N ' ' A' ' 125' ' ' ARG . 13.9 p30 -87.29 -32.41 19.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.027 0.441 . . . . 0.0 110.556 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.495 ' N ' ' OD1' ' A' ' 124' ' ' ASN . 4.1 ttt180 -86.34 9.25 18.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.406 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.528 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 21.3 p-10 -64.3 -71.23 0.18 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.791 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.528 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 54.9 mt -62.61 -35.73 80.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.545 0.212 . . . . 0.0 111.009 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.82 -41.36 67.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.324 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.5 m -61.77 -44.47 96.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.03 0.443 . . . . 0.0 110.15 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -46.58 80.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.6 -179.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.88 -42.81 99.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -66.96 -52.84 37.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.126 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -59.63 -47.88 83.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.364 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.8 tp -63.16 -48.8 76.91 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.268 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 47.8 tp -62.24 -42.62 99.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 11.4 tm0? -57.56 -41.2 80.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -107.21 72.12 0.86 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.51 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.484 ' O ' ' CD2' ' A' ' 138' ' ' TYR . 74.7 t80 -132.46 60.09 48.13 Favored Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.331 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.455 ' O ' ' O ' ' A' ' 140' ' ' ARG . 51.6 Cg_endo -71.4 -33.36 11.14 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 C-N-CA 122.59 2.193 . . . . 0.0 111.8 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.455 ' O ' ' O ' ' A' ' 139' ' ' PRO . 56.2 ttt-85 55.8 157.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.568 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.56 ' C ' ' H ' ' A' ' 143' ' ' GLU . 1.7 m-20 -62.22 -42.82 99.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.482 -179.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 70.0 mtp 65.32 -20.1 0.09 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.031 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.56 ' H ' ' C ' ' A' ' 141' ' ' ASP . 11.1 mt-10 -65.66 -43.79 88.29 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-O 120.876 0.37 . . . . 0.0 110.485 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -63.67 -31.03 72.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.776 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -75.86 -50.67 14.42 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.221 0.534 . . . . 0.0 110.924 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -68.25 -42.07 80.21 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.603 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.416 ' CB ' ' O ' ' A' ' 143' ' ' GLU . 99.6 m -62.15 -42.51 99.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.389 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 42.0 ttm -59.27 -46.33 88.81 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.65 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.3 -50.31 54.45 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 119.945 -0.702 . . . . 0.0 110.409 179.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -42.92 95.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.298 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.405 ' CB ' ' O ' ' A' ' 147' ' ' THR . 48.4 tp -60.93 -43.84 98.06 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.307 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.75 -43.76 98.22 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.156 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 51.9 tp -60.62 -41.86 95.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.554 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 66.2 mt -60.8 -41.76 96.28 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.103 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.416 ' O ' HG23 ' A' ' 159' ' ' VAL . 56.2 tp -62.33 -47.12 85.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.955 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.13 -36.52 79.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.505 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -61.42 -45.83 92.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.384 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.86 -38.99 93.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.51 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 155' ' ' LEU . 83.4 t -66.58 -44.46 89.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.316 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.33 -39.52 92.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.187 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 64.0 m -164.55 167.16 19.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.162 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.445 ' O ' ' C ' ' A' ' 163' ' ' THR . 33.2 m170 -112.63 115.55 28.76 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.445 ' C ' ' O ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER -29.39 93.55 0.05 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 123.442 0.464 . . . . 0.0 111.207 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.414 ' N ' ' O ' ' A' ' 162' ' ' HIS . 32.5 Cg_exo -55.16 143.69 73.47 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 121.875 1.716 . . . . 0.0 112.291 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 11.0 p -71.41 -170.93 0.56 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.828 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 37.1 mt 67.48 -59.24 0.41 Allowed 'General case' 0 N--CA 1.462 0.174 0 O-C-N 123.56 0.538 . . . . 0.0 110.502 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 50.2 mt -64.06 -35.56 81.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.356 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -64.35 -47.09 80.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.9 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.23 -46.74 85.55 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.926 0.393 . . . . 0.0 110.677 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.1 -44.84 97.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.322 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -60.45 -43.12 97.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -57.34 -48.89 77.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.721 -179.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 17.7 m -59.9 -47.09 87.17 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.5 m -53.48 -43.06 67.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.117 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 74.4 t -61.48 -40.86 87.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.326 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -59.53 -40.04 85.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.856 0.36 . . . . 0.0 110.417 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -61.45 -47.95 83.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.887 0.375 . . . . 0.0 110.491 179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 96.8 mt -69.32 -36.61 73.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.706 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -49.46 -33.79 15.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.853 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -52.65 148.3 7.41 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.344 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 48.9 t30 70.97 -55.59 0.64 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.064 0.459 . . . . 0.0 110.282 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 74.5 mt -61.71 -36.0 79.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.646 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . 0.431 ' O ' ' CB ' ' A' ' 187' ' ' ARG . 39.2 mmt-85 -54.37 -31.33 54.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.539 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.6 m -58.15 -47.92 81.84 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.555 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -73.42 -48.1 36.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.003 0.43 . . . . 0.0 111.001 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 86.0 t -62.17 -44.6 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.772 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . 0.431 ' CB ' ' O ' ' A' ' 183' ' ' ARG . 77.9 ttt-85 -62.22 -44.02 97.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.482 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . 0.49 ' O ' ' ND2' ' A' ' 192' ' ' ASN . 68.7 m -60.34 -40.76 91.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.886 0.374 . . . . 0.0 110.316 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 53.7 tp -64.06 -42.33 97.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . 0.432 ' O ' ' ND2' ' A' ' 192' ' ' ASN . . . -74.88 156.08 36.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.958 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 51.09 37.61 18.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.475 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.49 ' ND2' ' O ' ' A' ' 188' ' ' SER . 72.2 m-80 -154.86 153.14 30.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -79.46 -153.83 8.19 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 70.4 mmm -63.14 -40.09 96.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.654 0.264 . . . . 0.0 110.424 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.7 p-10 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.548 179.961 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -62.89 -41.64 99.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.817 0.341 . . . . 0.0 110.551 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -76.9 134.72 38.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.561 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.6 t 53.55 89.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.61 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.2 t -70.56 151.53 44.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.601 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.502 ' NE2' ' O ' ' A' ' 68' ' ' ARG . 80.8 t60 -67.95 132.49 47.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.379 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 32.0 t -141.96 46.6 1.65 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.445 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.502 ' O ' ' NE2' ' A' ' 66' ' ' HIS . 78.9 ttt-85 -156.13 87.01 1.04 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.346 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.91 144.96 43.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.313 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -62.16 169.58 13.3 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.434 ' O ' ' N ' ' A' ' 73' ' ' GLU . 22.6 mmt85 -64.02 -39.98 95.32 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.082 -0.247 . . . . 0.0 110.709 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.43 ' CG1' ' O ' ' A' ' 72' ' ' ILE . 3.9 tt 35.56 33.44 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 121.225 0.536 . . . . 0.0 111.264 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 71' ' ' ARG . 94.1 mt-10 -143.42 -59.07 0.41 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.824 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 75' ' ' ASP . . . -58.22 -23.36 55.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.46 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 77' ' ' GLU . 74.2 m-20 -58.87 -130.04 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.593 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 4.3 t 63.38 -67.53 0.09 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.719 0.295 . . . . 0.0 110.736 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 75' ' ' ASP . 45.1 mt-10 -59.84 -43.12 94.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.383 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.3 p -64.01 -33.48 75.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.723 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 68.22 -60.16 0.42 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.612 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.433 ' HB3' HH12 ' A' ' 84' ' ' ARG . 14.6 mm-40 -61.24 -33.75 74.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.378 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.433 ' OD2' ' OD1' ' A' ' 75' ' ' ASP . 32.8 t0 -58.4 -28.56 65.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.205 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 71.7 mt -60.91 -47.33 93.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.231 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.35 -45.1 99.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.433 HH12 ' HB3' ' A' ' 80' ' ' GLU . 84.1 mtt85 -55.82 -44.47 77.92 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.975 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -63.7 -45.09 91.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.017 0.437 . . . . 0.0 110.41 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.6 mt -58.17 -44.58 87.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.105 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.75 93.85 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.425 -0.51 . . . . 0.0 109.813 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -52.6 -45.56 66.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.047 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -46.59 89.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.155 0.502 . . . . 0.0 110.307 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.0 mp -62.22 -39.57 93.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.074 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.08 -41.32 78.6 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.017 0.437 . . . . 0.0 110.229 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -63.19 -51.9 64.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.111 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 86.1 t -69.91 -26.36 30.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.245 0.545 . . . . 0.0 110.342 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -73.64 -41.63 42.66 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -63.95 -42.97 97.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.775 0.322 . . . . 0.0 110.632 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 98' ' ' ASP . 51.1 m -57.09 -39.48 75.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.427 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -69.04 60.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.293 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.458 ' OD1' ' CD ' ' A' ' 103' ' ' PRO . 67.6 t0 -169.72 42.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.418 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -131.84 -38.38 1.13 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.0 t -101.59 0.58 36.61 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.857 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.64 ' O ' HG23 ' A' ' 101' ' ' ILE . 19.7 tt -138.34 62.04 28.76 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.018 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -36.72 98.53 0.02 OUTLIER 'Trans proline' 0 C--N 1.313 -1.332 0 C-N-CA 122.509 2.139 . . . . 0.0 111.632 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.458 ' CD ' ' OD1' ' A' ' 98' ' ' ASP . 69.4 Cg_endo -83.67 -82.22 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.369 2.046 . . . . 0.0 112.513 -179.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.481 ' O ' ' N ' ' A' ' 108' ' ' GLY . . . -45.2 -36.31 5.37 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.48 HD12 ' N ' ' A' ' 105' ' ' LEU . 10.9 mp -60.59 -64.56 0.91 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.075 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 85.6 t -64.32 -46.15 93.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.974 0.416 . . . . 0.0 110.732 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -63.38 -50.34 70.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.883 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 104' ' ' GLY . . . -60.71 -32.95 80.62 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.645 -0.982 . . . . 0.0 110.645 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 55.2 tp -61.54 -46.41 90.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -54.96 -48.93 72.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.117 -178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.427 HD12 ' N ' ' A' ' 111' ' ' LEU . 11.2 mp -65.84 -39.2 90.56 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.488 178.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -59.34 -45.26 91.86 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.124 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.4 tp -63.65 -42.59 98.09 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.699 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.66 HH12 ' NH2' ' A' ' 118' ' ' ARG . 59.2 ttm-85 -75.2 -42.89 54.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.009 0.433 . . . . 0.0 110.703 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -44.92 -17.55 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.171 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.479 ' N ' ' O ' ' A' ' 114' ' ' ARG . 16.4 m -59.23 -47.7 84.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 119' ' ' SER . 18.7 m -163.64 -137.56 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.052 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.66 ' NH2' HH12 ' A' ' 114' ' ' ARG . 72.2 mtp180 57.17 -78.93 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.605 179.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 117' ' ' SER . 29.7 t -82.83 -172.48 4.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.376 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.505 ' N ' ' OG ' ' A' ' 119' ' ' SER . 93.8 mt-10 59.44 9.06 1.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.504 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.467 ' C ' ' N ' ' A' ' 123' ' ' ARG . 75.9 mm-40 -105.67 179.93 4.12 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.71 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 50.2 p-10 -47.03 -16.49 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.459 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.467 ' N ' ' C ' ' A' ' 121' ' ' GLU . 62.1 ttm-85 -61.24 -44.52 97.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.559 ' O ' ' N ' ' A' ' 126' ' ' ASP . 61.6 t-20 -120.41 -73.24 0.65 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.814 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 39.6 ttm180 -51.84 85.23 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.165 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.559 ' N ' ' O ' ' A' ' 124' ' ' ASN . 66.6 t0 -173.43 -102.15 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.525 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.1 mt -50.32 -38.19 40.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.451 -178.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.81 -48.95 69.36 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.26 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 16.3 m -60.94 -42.78 98.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.574 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.52 -47.94 78.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.346 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.91 -41.59 87.62 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.459 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -55.44 -51.41 67.01 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.941 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -53.99 -47.73 71.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.678 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.21 -43.53 94.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.442 . . . . 0.0 109.966 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.55 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -56.4 -46.88 79.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.498 -178.079 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -55.77 -25.43 40.88 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.569 -0.452 . . . . 0.0 109.96 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.67 74.8 1.4 Allowed 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.775 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.662 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 12.3 t80 -90.28 -32.75 0.37 Allowed Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.775 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.662 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 51.3 Cg_exo -52.7 81.69 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.856 1.704 . . . . 0.0 112.359 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' A' ' 138' ' ' TYR . 13.7 ptm180 -155.59 159.25 39.5 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.765 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 54.91 34.6 22.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.63 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.6 ttp -160.46 -71.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.624 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -65.33 -35.12 80.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 26.9 tptt -61.53 -47.64 84.66 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.837 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.498 ' O ' HD13 ' A' ' 149' ' ' LEU . 80.5 mm-40 -64.01 -41.75 97.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.825 0.345 . . . . 0.0 110.569 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.526 ' O ' HG23 ' A' ' 150' ' ' VAL . 31.2 ttpt -58.29 -42.24 86.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.45 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.1 m -60.19 -46.84 88.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.709 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.2 mtm -64.59 -41.53 96.19 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.749 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 145' ' ' GLU . 7.7 mp -63.99 -41.1 97.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.727 0.299 . . . . 0.0 110.626 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 146' ' ' LYS . 53.8 t -60.83 -45.06 98.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.476 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.2 tp -61.39 -45.41 94.49 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.463 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.94 -37.0 86.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.639 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.87 -41.92 99.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.417 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.02 -47.13 86.13 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.18 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.42 ' O ' HG23 ' A' ' 159' ' ' VAL . 91.4 mt -61.39 -43.31 99.08 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.023 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -71.65 -46.62 58.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.47 179.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.97 -37.46 87.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.507 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -61.07 -44.55 97.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.596 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 155' ' ' LEU . 53.1 t -60.17 -48.81 86.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.323 -179.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -72.14 -38.54 69.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.952 0.406 . . . . 0.0 110.955 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . 0.564 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 29.4 t -72.04 -165.57 0.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.416 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.564 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.9 m-70 167.38 89.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.119 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.1 p -123.74 152.98 66.64 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.584 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -68.03 156.36 66.14 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.489 2.126 . . . . 0.0 111.7 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 83.8 p -94.24 -6.5 44.45 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.624 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 56.7 mt -63.77 -50.33 69.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.794 0.33 . . . . 0.0 111.07 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.539 HD22 ' N ' ' A' ' 167' ' ' LEU . 3.9 mm? -67.92 -38.37 82.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.519 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -61.87 -38.02 86.72 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.42 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -62.72 -46.89 85.99 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.557 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.0 t -66.63 -48.92 78.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 121.049 0.452 . . . . 0.0 110.143 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -56.23 -39.46 72.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.628 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -61.56 -41.37 97.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.687 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 99.3 m -59.54 -46.59 88.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.551 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 81.7 m -57.88 -43.71 86.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.111 0.481 . . . . 0.0 110.029 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.9 t -56.67 -43.79 79.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.721 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -62.4 -38.23 88.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.771 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -56.62 -46.05 81.17 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.758 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.412 HD12 ' N ' ' A' ' 178' ' ' ILE . 2.1 mp -62.38 -38.36 81.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -60.35 -33.71 72.81 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.882 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 182' ' ' LEU . 50.9 tt0 -83.92 118.13 23.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.431 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 7.3 m120 62.16 -57.95 0.13 Allowed 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.502 ' N ' ' O ' ' A' ' 180' ' ' GLN . 11.1 mp -48.43 -35.84 13.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.169 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 187' ' ' ARG . 61.0 ttt85 -51.51 -43.28 62.2 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.498 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -63.44 -52.3 62.04 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.749 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -68.5 -41.0 80.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.833 0.349 . . . . 0.0 111.282 -179.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 189' ' ' LEU . 40.7 t -62.76 -45.77 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.552 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . 0.543 ' NH2' ' NH2' ' A' ' 183' ' ' ARG . 64.5 ttm-85 -60.56 -52.54 64.74 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.42 -178.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 79.8 p -63.72 -38.95 93.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.726 0.298 . . . . 0.0 110.616 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.466 ' O ' ' O ' ' A' ' 190' ' ' ALA . 54.7 tp -82.78 124.94 30.74 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.308 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . 0.466 ' O ' ' O ' ' A' ' 189' ' ' LEU . . . 54.61 112.44 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.564 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -62.82 135.0 57.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.43 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -97.84 11.1 38.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.308 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -59.72 156.17 28.16 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 50.9 ttp -84.6 128.9 34.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.799 0.333 . . . . 0.0 110.543 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.6 t0 . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.836 179.799 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.352 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.7 p-10 -81.39 -6.85 59.35 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.767 0.318 . . . . 0.0 110.628 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -149.86 161.07 43.0 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.562 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 62.3 p -151.37 110.04 3.83 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.453 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 52.5 m -61.7 -42.49 99.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.562 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -143.42 146.73 33.7 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.497 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.1 p -102.25 76.11 1.55 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.497 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 78.8 mtp85 -92.73 6.12 48.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.692 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.604 HD12 ' N ' ' A' ' 69' ' ' LEU . 9.6 mp -77.71 133.01 38.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.192 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -154.38 -50.07 0.01 OUTLIER Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.439 ' O ' ' O ' ' A' ' 72' ' ' ILE . 84.0 mtp180 -91.65 -2.24 57.14 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.88 0.371 . . . . 0.0 110.493 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.624 HG22 ' N ' ' A' ' 73' ' ' GLU . 82.8 mt 54.34 166.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.364 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.624 ' N ' HG22 ' A' ' 72' ' ' ILE . 0.1 OUTLIER 79.77 -34.18 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.281 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -82.25 2.41 32.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.453 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -79.86 22.41 0.49 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.567 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 92.5 p -55.65 -26.12 42.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.284 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -65.69 -22.95 66.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.284 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 89.0 p -63.54 -19.99 65.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.481 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.38 -9.47 56.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.18 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -71.34 -37.0 71.74 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.434 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -60.35 -51.48 69.32 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.281 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.406 HG23 ' N ' ' A' ' 83' ' ' ILE . 12.9 tt -65.18 -41.3 91.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.094 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.406 ' N ' HG23 ' A' ' 82' ' ' ILE . 73.6 mt -63.09 -42.35 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.171 178.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -55.72 -48.77 74.6 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.623 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -60.84 -41.79 96.53 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.515 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.01 -44.63 95.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.897 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.85 -46.28 78.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.803 0.335 . . . . 0.0 110.35 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 95.2 mtm-85 -56.25 -43.52 78.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.649 -179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -64.12 -45.54 88.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.085 0.469 . . . . 0.0 110.475 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.05 -35.69 80.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.204 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.77 -47.51 82.32 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.712 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.95 -52.52 55.84 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.529 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.73 -25.93 31.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.758 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.546 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -84.44 -35.34 14.42 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.318 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -65.15 -47.15 78.07 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.537 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 29.8 t -166.0 152.63 9.54 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.725 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 8.7 tpt -154.93 128.72 8.67 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.144 0.497 . . . . 0.0 110.602 179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.733 ' O ' HG22 ' A' ' 101' ' ' ILE . 89.7 m-20 40.09 65.04 0.79 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.226 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.487 ' C ' ' H ' ' A' ' 101' ' ' ILE . 90.1 mtm180 -38.02 -24.07 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.188 0.518 . . . . 0.0 110.598 -179.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 98' ' ' ASP . 26.8 t -73.08 17.86 0.12 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.628 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.733 HG22 ' O ' ' A' ' 98' ' ' ASP . 18.8 tt -131.64 53.9 12.84 Favored Pre-proline 0 N--CA 1.468 0.459 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.281 -179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.461 ' O ' HG12 ' A' ' 106' ' ' VAL . 85.4 Cg_exo -32.16 94.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.78 2.32 . . . . 0.0 112.159 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -84.29 -86.92 0.0 OUTLIER 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.153 1.902 . . . . 0.0 111.874 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.541 ' O ' ' N ' ' A' ' 108' ' ' GLY . . . -65.24 -23.48 69.93 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.094 -0.802 . . . . 0.0 111.094 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.443 ' N ' ' CD2' ' A' ' 105' ' ' LEU . 4.0 mm? -59.68 -71.03 0.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.63 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 107' ' ' ASN . 12.7 p -61.17 -43.77 97.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.643 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.56 ' N ' HG13 ' A' ' 106' ' ' VAL . 50.2 t-20 -65.84 -36.4 83.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.965 0.412 . . . . 0.0 110.489 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 104' ' ' GLY . . . -47.99 -26.04 4.18 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.516 ' N ' HD22 ' A' ' 109' ' ' LEU . 4.0 mm? -62.66 -43.48 98.69 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.022 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.06 -40.09 69.95 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.58 -0.448 . . . . 0.0 109.893 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 50.6 tp -66.69 -41.47 88.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.708 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -54.68 -42.78 71.83 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.31 -40.44 97.34 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.435 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -74.06 -28.12 61.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.985 0.421 . . . . 0.0 110.596 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.538 ' O ' ' NE ' ' A' ' 118' ' ' ARG . 93.7 m-20 -63.57 -41.88 98.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 t -73.38 -33.7 65.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.696 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.574 ' C ' ' H ' ' A' ' 119' ' ' SER . 92.6 p -54.69 -82.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.738 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.538 ' NE ' ' O ' ' A' ' 115' ' ' ASN . 82.1 mtt-85 65.51 -34.24 0.18 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.017 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.574 ' H ' ' C ' ' A' ' 117' ' ' SER . 32.4 t -63.21 -42.92 99.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.008 0.433 . . . . 0.0 110.847 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 35.9 tp10 -64.42 -41.46 96.59 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.526 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -87.44 -172.45 3.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.116 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.767 ' H ' ' HE ' ' A' ' 125' ' ' ARG . 98.3 m-20 57.99 40.22 25.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.738 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.2 mtp85 -126.46 -57.17 1.38 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.623 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -85.11 -41.71 15.45 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.939 0.4 . . . . 0.0 110.921 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.767 ' HE ' ' H ' ' A' ' 122' ' ' ASP . 26.6 ptt180 -74.27 -7.41 52.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.297 -179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' A' ' 127' ' ' LEU . 25.6 p-10 -48.23 -71.04 0.07 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.331 -179.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.544 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 51.9 mt -67.1 -34.24 77.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.826 0.346 . . . . 0.0 110.812 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -39.39 66.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.1 m -62.03 -47.35 85.13 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.433 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.72 -43.59 94.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.946 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.28 -41.7 98.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 110.476 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -60.31 -46.58 89.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.358 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.46 -52.65 63.65 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.65 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.2 tp -63.24 -49.49 73.94 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.157 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 56.7 tp -57.19 -38.08 73.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.274 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -57.15 -27.48 61.91 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.261 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -135.27 60.24 1.7 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.001 0.429 . . . . 0.0 110.906 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.646 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 17.0 t80 -90.1 -32.27 0.37 Allowed Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.768 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.646 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 51.1 Cg_exo -53.0 85.76 0.03 OUTLIER 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.891 1.727 . . . . 0.0 112.235 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 138' ' ' TYR . 14.3 ptm180 -148.32 153.02 38.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.803 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 49.55 51.99 15.38 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.459 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 38.8 ttm -105.48 -32.69 8.41 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.452 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.407 ' O ' ' OG1' ' A' ' 147' ' ' THR . 43.5 tp10 -67.16 -35.07 78.9 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.73 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.58 -31.58 69.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.725 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -69.05 -47.95 64.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.148 0.499 . . . . 0.0 110.815 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.419 ' O ' HG23 ' A' ' 150' ' ' VAL . 53.8 mtmt -67.24 -38.13 84.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.721 178.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 143' ' ' GLU . 10.2 m -58.55 -43.27 89.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.113 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.5 mtt -61.41 -46.4 90.29 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.04 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.6 mp -65.71 -45.85 81.21 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 119.622 -0.831 . . . . 0.0 110.466 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 146' ' ' LYS . 64.9 t -60.53 -42.54 91.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 -179.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 27.1 mt -60.01 -42.59 94.63 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.036 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.73 -43.74 95.62 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.174 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.567 HD11 ' NZ ' ' A' ' 157' ' ' LYS . 38.0 tp -60.72 -42.31 97.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 83.0 mt -61.25 -43.43 98.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.049 0.452 . . . . 0.0 110.158 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.422 ' O ' HG23 ' A' ' 159' ' ' VAL . 88.9 mt -63.41 -44.09 95.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.054 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.23 -35.46 76.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.939 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.567 ' NZ ' HD11 ' A' ' 153' ' ' LEU . 26.8 mmtm -60.27 -48.99 79.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.044 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -67.31 -40.75 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.022 0.439 . . . . 0.0 110.897 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 155' ' ' LEU . 71.1 t -67.71 -44.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.535 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.75 96.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.04 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . 0.421 ' O ' ' O ' ' A' ' 157' ' ' LYS . 25.8 t -173.51 179.2 2.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.351 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -128.42 143.94 51.07 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.063 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.4 p -78.36 150.05 76.37 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.607 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.48 156.34 61.67 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.26 1.974 . . . . 0.0 112.012 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . 0.401 ' O ' ' CB ' ' A' ' 166' ' ' LEU . 72.3 m -85.45 179.93 7.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.381 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.429 HD13 ' O ' ' A' ' 166' ' ' LEU . 0.2 OUTLIER 76.73 -59.41 0.49 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.654 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.549 HD12 ' N ' ' A' ' 167' ' ' LEU . 9.0 mp -62.64 -26.02 68.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.088 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.45 -42.64 99.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.342 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.14 -45.79 86.96 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.996 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.69 -44.53 96.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.467 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.88 -41.9 92.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.284 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.96 -48.71 80.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.612 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.8 m -59.3 -46.73 87.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.078 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.6 m -52.94 -43.11 66.07 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.986 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.4 t -61.04 -44.98 99.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.366 179.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -72.13 -30.76 65.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.024 0.44 . . . . 0.0 110.464 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -58.15 -41.04 82.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.58 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.8 mt -60.31 -42.52 90.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.599 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -49.81 -34.53 19.88 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.787 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -49.37 -88.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.468 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -88.4 58.1 4.55 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.304 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp -61.72 -40.29 94.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.715 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . 0.421 ' HD3' ' H ' ' A' ' 183' ' ' ARG . 0.7 OUTLIER -61.47 -45.65 93.37 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 18.9 m -58.0 -46.64 84.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.855 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -54.19 -41.97 69.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.61 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.465 HG22 HD21 ' A' ' 192' ' ' ASN . 70.9 t -60.3 -50.83 78.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.284 -0.567 . . . . 0.0 110.246 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -67.85 -33.83 75.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.274 0.559 . . . . 0.0 110.475 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 35.2 t -58.04 -44.08 87.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.172 -179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.68 HD23 ' N ' ' A' ' 190' ' ' ALA . 1.0 OUTLIER -172.75 135.27 0.64 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.365 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . 0.68 ' N ' HD23 ' A' ' 189' ' ' LEU . . . -54.91 78.62 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . 0.597 ' N ' ' O ' ' A' ' 189' ' ' LEU . 79.7 ttt-85 -92.31 -97.91 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.285 -179.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.465 HD21 HG22 ' A' ' 186' ' ' VAL . 12.7 m120 53.53 35.48 20.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.788 0.328 . . . . 0.0 110.618 179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . 0.44 ' H ' ' HG2' ' A' ' 191' ' ' ARG . . . 177.24 -168.54 40.35 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . 0.501 ' O ' ' NH2' ' A' ' 191' ' ' ARG . 0.0 OUTLIER 53.96 109.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.928 0.394 . . . . 0.0 110.683 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.7 t0 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.416 179.891 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -81.69 131.82 35.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.862 0.363 . . . . 0.0 110.437 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -141.34 124.74 16.61 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.329 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.2 t -68.81 137.72 54.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.478 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.526 ' O ' ' CG ' ' A' ' 66' ' ' HIS . 34.9 t -62.01 -44.15 97.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.434 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.526 ' CG ' ' O ' ' A' ' 65' ' ' SER . 91.4 m-70 -157.86 162.1 38.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.591 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.6 t -65.69 139.81 58.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.496 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.574 ' O ' ' N ' ' A' ' 70' ' ' GLY . 83.2 mtp180 -61.2 -45.14 95.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.889 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 78.7 mt 57.04 -74.18 0.02 OUTLIER 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.704 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 68' ' ' ARG . . . 107.17 20.98 8.3 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 44.08 34.82 1.03 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 110.723 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 28.4 pt -66.69 -22.61 30.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.502 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.501 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 97.4 mt-10 -78.1 -174.26 3.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.524 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 73' ' ' GLU . . . 70.5 -56.15 0.61 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.546 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -81.4 23.25 0.63 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.623 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.0 p -55.89 -36.58 67.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.548 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.0 tm-20 -122.17 112.95 18.82 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.223 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 80' ' ' GLU . 60.5 m 46.67 -106.01 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.343 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 68.0 -38.43 0.36 Allowed 'General case' 0 CA--C 1.528 0.115 0 O-C-N 123.495 0.497 . . . . 0.0 110.738 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.52 ' H ' ' C ' ' A' ' 78' ' ' SER . 16.5 mm-40 -64.81 -33.74 76.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.276 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -58.22 -30.79 66.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.342 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.13 -45.95 97.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.874 0.369 . . . . 0.0 110.187 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.12 -42.1 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.507 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -56.49 -44.57 80.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.478 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -64.67 -41.53 96.02 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 110.528 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 80.4 mt -60.14 -41.73 87.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.208 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.141 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 75.8 mtp85 -54.63 -45.74 73.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.431 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -63.69 -49.93 71.2 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.387 0.613 . . . . 0.0 110.232 179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 92.0 mt -62.1 -32.56 73.13 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.903 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -65.58 -36.33 83.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.264 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -63.56 -52.04 62.79 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.229 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.02 -26.37 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.415 0.626 . . . . 0.0 110.715 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.21 -38.56 10.95 Favored Glycine 0 N--CA 1.466 0.644 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.66 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.6 t70 -78.75 -44.07 24.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.415 0.15 . . . . 0.0 111.045 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 5.0 m -77.02 121.47 23.56 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.086 0.469 . . . . 0.0 110.809 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 94.0 mmm -140.38 19.45 2.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.557 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -63.23 -38.92 93.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.725 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -61.51 -40.41 94.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.651 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.9 m -82.34 -73.48 0.39 Allowed 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.519 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 4.3 pt -102.46 147.21 33.67 Favored Pre-proline 0 N--CA 1.464 0.271 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.77 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.21 150.42 76.75 Favored 'Trans proline' 0 C--N 1.311 -1.398 0 C-N-CA 122.152 1.901 . . . . 0.0 112.094 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -71.83 153.13 58.77 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.751 2.301 . . . . 0.0 112.003 179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.534 ' O ' ' N ' ' A' ' 106' ' ' VAL . . . 39.13 -137.38 1.09 Allowed Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.146 -0.782 . . . . 0.0 111.146 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 105' ' ' LEU . 10.8 mp 56.94 -77.96 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.745 0.307 . . . . 0.0 110.728 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.534 ' N ' ' O ' ' A' ' 104' ' ' GLY . 9.9 p -55.51 -43.34 72.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.98 0.419 . . . . 0.0 110.525 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.505 ' N ' HG13 ' A' ' 106' ' ' VAL . 65.8 t30 -75.73 -49.33 18.56 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.633 179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -60.34 -34.81 86.48 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 17.2 mt -61.55 -42.3 98.63 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.941 -0.304 . . . . 0.0 110.481 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.51 -39.16 70.14 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.371 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.2 mt -67.78 -38.19 83.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.848 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -59.12 -40.6 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.151 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.554 ' O ' HG22 ' A' ' 116' ' ' THR . 4.2 mm? -63.13 -42.56 99.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.923 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 67.7 ttt-85 -78.43 -42.1 31.04 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.038 0.447 . . . . 0.0 110.677 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.579 ' C ' ' H ' ' A' ' 117' ' ' SER . 97.8 m-20 -48.78 -31.78 7.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.833 -178.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.554 HG22 ' O ' ' A' ' 113' ' ' LEU . 1.4 t -59.78 3.71 0.05 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.585 179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.579 ' H ' ' C ' ' A' ' 115' ' ' ASN . 9.4 p 54.76 46.04 25.42 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.95 0.405 . . . . 0.0 110.448 -178.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.429 ' CG ' ' N ' ' A' ' 119' ' ' SER . 13.8 ptm180 -58.55 -46.18 87.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.645 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.429 ' N ' ' CG ' ' A' ' 118' ' ' ARG . 67.0 m -166.98 153.73 8.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.566 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -83.86 72.61 10.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.202 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -58.52 -17.39 20.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -87.8 10.69 17.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.432 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.54 -43.96 96.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.494 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.515 ' C ' ' H ' ' A' ' 126' ' ' ASP . 15.6 m120 -65.82 -39.47 90.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.236 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.533 ' NH1' ' OE2' ' A' ' 132' ' ' GLU . 0.0 OUTLIER -71.27 17.44 0.08 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.373 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.515 ' H ' ' C ' ' A' ' 124' ' ' ASN . 42.8 t0 -74.69 -78.58 0.1 Allowed 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.733 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 51.5 mt -66.75 -34.99 79.04 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.835 0.35 . . . . 0.0 111.019 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -36.12 63.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.797 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 72.4 m -61.23 -46.76 89.09 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.446 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.76 -46.53 89.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.581 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.5 mt -62.37 -42.88 99.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.638 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.533 ' OE2' ' NH1' ' A' ' 125' ' ' ARG . 93.3 mt-10 -62.61 -48.94 77.23 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.668 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -58.86 -43.14 90.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.425 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 46.2 tp -63.57 -46.92 83.68 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.325 -0.55 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.596 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.43 -37.75 76.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.294 0.569 . . . . 0.0 110.59 -178.001 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -55.84 -25.45 42.05 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.416 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -162.01 93.14 0.87 Allowed 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.655 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.636 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 5.0 p90 -131.49 75.7 76.53 Favored Pre-proline 0 N--CA 1.47 0.574 0 CA-C-O 121.777 0.799 . . . . 0.0 110.654 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -79.92 47.3 2.48 Favored 'Trans proline' 0 C--N 1.299 -2.032 0 C-N-CA 122.242 1.961 . . . . 0.0 111.647 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.417 ' O ' ' N ' ' A' ' 142' ' ' MET . 76.9 ttt180 -68.06 129.84 41.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.682 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' A' ' 143' ' ' GLU . 99.4 m-20 39.25 -97.0 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.737 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . 0.417 ' N ' ' O ' ' A' ' 140' ' ' ARG . 38.1 ttm 60.8 -73.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.481 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.525 ' N ' ' O ' ' A' ' 141' ' ' ASP . 82.9 tt0 -68.38 -33.9 75.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.618 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -61.74 -34.83 76.52 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -69.87 -38.91 76.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.575 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -68.32 -39.98 81.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.964 179.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 85.4 m -60.12 -43.01 95.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.312 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 56.1 tpp -60.27 -46.82 88.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.227 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.02 -46.5 71.05 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.5 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 67.9 t -62.26 -41.89 93.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.402 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 47.9 tp -58.28 -45.79 87.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.389 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -62.12 -39.78 93.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.976 0.417 . . . . 0.0 110.266 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 44.3 tp -60.39 -41.22 93.38 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.83 -44.43 96.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.116 0.484 . . . . 0.0 110.068 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.01 -45.4 92.52 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.213 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.07 -35.81 78.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.549 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -60.31 -47.45 85.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.489 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -63.23 -39.23 94.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.065 0.46 . . . . 0.0 110.428 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 78.0 t -68.35 -43.17 84.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.557 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.25 99.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.333 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 46.3 t -156.24 154.74 31.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 110.548 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -81.96 -35.8 28.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.611 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 m 64.95 84.38 0.18 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.224 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.97 147.61 62.4 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 122.725 2.283 . . . . 0.0 112.232 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 31.1 t -64.86 113.63 3.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.469 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 55.6 tp -174.09 -80.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.327 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 61.3 mt -62.69 -25.6 68.24 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.516 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -60.84 -43.93 97.64 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.372 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -70.01 -43.88 70.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.036 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 85.3 t -62.05 -46.73 95.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.603 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -65.01 -37.06 86.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.727 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -59.69 -49.42 77.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.302 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.3 m -59.58 -46.13 89.85 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.863 0.363 . . . . 0.0 110.371 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.0 m -53.22 -43.8 67.56 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 84.7 t -62.44 -43.17 97.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.772 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -66.34 -38.65 88.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.944 0.402 . . . . 0.0 110.842 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -60.09 -39.92 87.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.561 -179.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.2 mt -61.93 -42.27 94.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.6 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.478 ' O ' ' O ' ' A' ' 180' ' ' GLN . 98.5 m-20 -52.05 -34.33 42.98 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.222 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.478 ' O ' ' O ' ' A' ' 179' ' ' ASN . 87.1 mt-30 -38.73 -100.57 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.194 0.521 . . . . 0.0 111.103 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -130.32 -8.01 4.24 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.142 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.491 ' O ' HG23 ' A' ' 186' ' ' VAL . 10.9 mp -59.8 -36.09 76.04 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.448 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . 0.445 ' HE ' ' HA ' ' A' ' 179' ' ' ASN . 5.9 ptp180 -50.74 -45.03 58.59 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.128 -177.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.6 m -62.32 -50.41 71.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.14 0.495 . . . . 0.0 110.456 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -65.35 -36.94 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.729 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 182' ' ' LEU . 40.4 t -61.46 -46.29 96.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.493 -179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -60.61 -53.61 55.39 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.146 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 47.9 m -58.71 -40.19 82.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.872 0.368 . . . . 0.0 110.432 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 25.4 mt -62.79 -42.16 99.58 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.59 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . 0.46 ' O ' ' O ' ' A' ' 191' ' ' ARG . . . -168.57 156.81 8.28 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.065 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . 0.46 ' O ' ' O ' ' A' ' 190' ' ' ALA . 95.7 mtt-85 57.59 131.78 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 O-C-N 123.503 0.502 . . . . 0.0 110.766 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.414 ' OD1' ' O ' ' A' ' 192' ' ' ASN . 44.8 p30 -160.94 140.45 10.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.433 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . 72.88 27.86 68.06 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 75.2 mtm -63.59 -40.56 97.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.804 0.335 . . . . 0.0 110.476 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.4 t0 . . . . . 0 C--O 1.22 -0.447 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.638 179.996 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.311 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -62.84 -41.5 99.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.774 0.321 . . . . 0.0 110.531 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.719 ' HE ' ' NE ' ' A' ' 99' ' ' ARG . 84.1 mtp180 -76.33 142.05 41.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.443 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.9 m 54.01 87.89 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.478 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -132.73 41.24 3.19 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.465 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 44.28 -167.39 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.718 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.4 p -71.75 162.66 29.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.25 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 17.9 mmm180 -108.45 94.13 4.89 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.297 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.5 mt -113.54 134.15 54.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.178 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -168.45 -35.94 0.02 OUTLIER Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.441 HH21 HD11 ' A' ' 86' ' ' ILE . 88.0 mtm180 -89.85 37.95 0.9 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.882 0.373 . . . . 0.0 110.817 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 68.2 mt -65.76 -43.24 93.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.396 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 58.1 mp0 -66.61 -35.98 81.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.513 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -85.86 60.14 6.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.504 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 50.7 p-10 -142.37 14.59 2.01 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.421 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 77.7 p -61.58 -42.25 98.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.632 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -65.38 -41.83 93.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.437 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 3.0 t -151.75 143.86 23.91 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.141 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -120.82 -46.94 2.32 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.545 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.63 -41.59 88.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.748 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -63.37 -39.36 94.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.0 mm -61.36 -44.16 97.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.232 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 94.0 mt -61.9 -41.74 91.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.179 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -59.88 -40.39 88.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.76 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.422 ' HA ' ' HE ' ' A' ' 88' ' ' ARG . 59.9 t-20 -66.65 -52.46 44.75 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.807 0.337 . . . . 0.0 110.943 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.441 HD11 HH21 ' A' ' 71' ' ' ARG . 1.4 mp -58.9 -38.31 72.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.017 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.99 -51.75 68.71 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.226 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.422 ' HE ' ' HA ' ' A' ' 85' ' ' ASN . 87.9 mtm180 -54.32 -48.95 70.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.44 -179.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -66.94 -45.16 78.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.398 0.618 . . . . 0.0 110.245 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.3 tt -59.65 -40.66 88.42 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.273 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.89 -46.92 86.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.382 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -56.03 -52.18 65.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.27 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.5 t -74.51 -25.99 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.429 0.633 . . . . 0.0 110.719 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.534 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -72.33 -24.1 76.88 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.862 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.496 ' O ' ' CB ' ' A' ' 96' ' ' SER . 99.6 m-20 -72.58 -46.82 52.45 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.921 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.496 ' CB ' ' O ' ' A' ' 95' ' ' ASP . 1.8 m 158.23 -79.54 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.64 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.438 ' O ' ' O ' ' A' ' 96' ' ' SER . 24.7 mmm 57.87 121.4 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.453 -179.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 53.21 21.47 2.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.545 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.719 ' NE ' ' HE ' ' A' ' 63' ' ' ARG . 83.8 mtp180 -138.83 -32.49 0.68 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.481 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.433 ' O ' HG23 ' A' ' 101' ' ' ILE . 7.3 t -163.39 80.55 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.955 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.501 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 14.1 pt -155.12 49.98 0.48 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.412 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 82.1 Cg_exo -35.41 99.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 123.026 2.484 . . . . 0.0 111.835 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.45 ' O ' ' O ' ' A' ' 104' ' ' GLY . 52.4 Cg_exo -53.23 135.06 59.01 Favored 'Trans proline' 0 N--CA 1.495 1.585 0 C-N-CA 122.291 1.994 . . . . 0.0 112.326 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.507 ' O ' ' N ' ' A' ' 106' ' ' VAL . . . 44.28 -169.47 0.02 OUTLIER Glycine 0 C--N 1.335 0.49 0 N-CA-C 109.917 -1.273 . . . . 0.0 109.917 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.597 HD12 ' N ' ' A' ' 105' ' ' LEU . 9.1 mp 64.08 -45.98 0.28 Allowed 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.866 0.392 . . . . 0.0 110.708 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.507 ' N ' ' O ' ' A' ' 104' ' ' GLY . 9.1 p -54.86 -39.01 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.188 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.531 ' OD1' ' N ' ' A' ' 108' ' ' GLY . 45.0 p-10 -58.63 -29.73 66.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.341 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.531 ' N ' ' OD1' ' A' ' 107' ' ' ASN . . . -69.71 -50.38 30.9 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 109' ' ' LEU . 8.7 mp -63.0 -42.38 99.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.929 0.395 . . . . 0.0 110.434 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.94 -49.04 76.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.629 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 72.2 mt -71.01 -44.04 66.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.919 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.3 tm0? -57.63 -41.2 80.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.12 -43.9 97.82 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 119.809 -0.756 . . . . 0.0 110.142 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 84.2 mtt85 -71.87 -28.71 63.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.047 0.451 . . . . 0.0 110.268 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -62.87 -38.09 89.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.738 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.9 t -89.61 10.28 23.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.3 p -91.76 -5.61 53.28 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.66 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 83.4 mtt85 -68.0 -19.8 64.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.612 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.6 m -73.34 -6.55 46.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.638 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -169.25 126.83 0.95 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.591 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -174.86 -52.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.579 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -67.3 -19.53 65.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.527 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.431 ' O ' ' N ' ' A' ' 125' ' ' ARG . 84.4 mtp180 -57.14 -111.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.75 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -67.68 69.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.687 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' A' ' 123' ' ' ARG . 59.0 ttm-85 -157.46 -29.56 0.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.394 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -48.92 -82.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.321 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.2 mt -51.24 -33.43 28.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.756 0.312 . . . . 0.0 110.725 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -49.36 69.73 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.435 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.4 m -61.69 -43.15 99.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.99 78.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.429 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 95.2 mt -59.49 -41.64 90.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -62.56 -50.19 72.31 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.163 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -55.33 -45.54 76.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.449 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.56 -47.82 82.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.019 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.548 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -57.39 -41.23 79.86 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.7 -177.678 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -56.03 -25.41 44.48 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.126 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -124.68 77.36 1.59 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.787 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.68 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 46.6 t80 -97.41 -30.9 0.25 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.01 178.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.68 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 77.8 Cg_exo -47.92 96.63 0.03 OUTLIER 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 122.099 1.866 . . . . 0.0 112.341 -178.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.442 ' O ' ' O ' ' A' ' 141' ' ' ASP . 90.9 mtm180 -137.68 -86.17 0.29 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.563 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.538 ' CG ' ' H ' ' A' ' 142' ' ' MET . 41.6 p-10 -55.71 -113.49 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.858 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . 0.538 ' H ' ' CG ' ' A' ' 141' ' ' ASP . 18.3 tpp 61.39 -95.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.81 -37.25 86.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.842 0.353 . . . . 0.0 110.756 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.2 ttmt -60.54 -38.17 83.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.09 0.471 . . . . 0.0 111.156 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -75.96 -34.54 59.83 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.621 178.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -71.79 -40.88 68.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.554 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 18.8 m -62.1 -44.11 97.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.536 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 19.1 mtm -61.67 -44.03 97.74 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.5 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 93.8 mt -67.91 -49.57 61.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.59 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 78.2 t -62.56 -43.2 98.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.378 -179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 49.8 tp -58.98 -45.46 90.54 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.439 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.03 -42.53 97.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.043 0.449 . . . . 0.0 110.275 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 24.2 tp -59.16 -41.85 89.36 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.115 -178.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.4 -44.32 97.35 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.545 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 93.6 mt -64.26 -46.61 82.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.356 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.26 -43.98 80.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.102 0.477 . . . . 0.0 110.43 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.56 -38.7 91.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.128 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -60.52 -41.27 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.321 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 88.5 t -66.38 -45.11 90.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.559 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -65.15 -35.34 80.78 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.05 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 35.9 p -157.73 160.93 38.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.198 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.461 ' O ' ' O ' ' A' ' 163' ' ' THR . 55.2 m80 -128.39 50.05 2.12 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.369 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.461 ' O ' ' O ' ' A' ' 162' ' ' HIS . 14.4 p 56.95 147.84 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.0 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.433 ' O ' ' CB ' ' A' ' 165' ' ' SER . 56.8 Cg_endo -70.74 -91.01 0.01 OUTLIER 'Trans proline' 0 N--CA 1.496 1.64 0 C-N-CA 122.153 1.902 . . . . 0.0 111.75 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.6 m 164.68 -68.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.112 0.482 . . . . 0.0 110.348 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 16.9 tp -65.09 -41.52 94.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.939 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.581 HD22 ' N ' ' A' ' 167' ' ' LEU . 3.9 mm? -64.44 -25.5 68.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.806 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.09 -43.81 73.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.876 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -66.76 -46.93 73.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.028 0.442 . . . . 0.0 110.913 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.5 -44.27 94.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.421 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . 0.4 ' O ' HG23 ' A' ' 175' ' ' VAL . 81.6 t80 -61.49 -37.62 84.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.486 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -60.68 -49.71 76.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.411 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.2 m -59.13 -42.51 90.81 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.53 -42.47 87.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.224 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 171' ' ' PHE . 69.6 t -61.76 -37.99 79.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.471 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -61.0 -41.12 95.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.867 0.365 . . . . 0.0 110.359 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -62.26 -47.33 84.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.111 0.481 . . . . 0.0 110.491 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 67.5 mt -70.26 -34.59 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.827 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.407 ' O ' ' N ' ' A' ' 181' ' ' ASN . 52.5 m-20 -48.67 -34.18 11.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.556 -178.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -43.26 -24.83 0.1 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.947 0.404 . . . . 0.0 110.881 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 179' ' ' ASN . 56.1 t-20 -116.67 -48.91 2.66 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.011 -179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.52 -36.05 77.45 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.519 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -51.81 -30.84 24.91 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.224 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 75.3 m -59.32 -51.42 70.01 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.836 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -70.6 -43.77 68.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.067 0.461 . . . . 0.0 110.889 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 69.6 t -64.35 -43.9 97.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.572 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -59.57 -45.2 92.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.562 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 37.6 m -59.22 -31.95 69.51 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.351 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.569 HD13 ' O ' ' A' ' 189' ' ' LEU . 0.2 OUTLIER -61.99 -44.19 97.24 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.181 -179.035 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -147.07 140.46 25.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.438 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -65.21 -43.23 92.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.743 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -83.39 113.43 20.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.454 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -63.62 -41.46 99.09 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 111.076 -0.809 . . . . 0.0 111.076 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 66.6 mtt -114.46 140.89 48.35 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.914 0.388 . . . . 0.0 110.522 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.3 p-10 . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.555 -179.842 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -63.06 -40.22 97.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.685 0.279 . . . . 0.0 110.482 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -79.37 132.81 36.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.409 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 m -73.06 135.36 44.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.394 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.454 ' O ' ' O ' ' A' ' 66' ' ' HIS . 94.9 p -106.29 -2.16 22.63 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.436 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.454 ' O ' ' O ' ' A' ' 65' ' ' SER . 68.6 m80 57.9 127.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 39.8 m -58.72 -34.99 71.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.574 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.5 mmt180 48.15 74.58 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.566 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 69' ' ' LEU . 10.8 mp -63.36 -43.33 98.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.442 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 43.83 -118.49 2.25 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.845 -0.902 . . . . 0.0 110.845 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 24.4 mmt85 -83.68 133.03 34.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.877 0.37 . . . . 0.0 110.167 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.457 HG23 ' O ' ' A' ' 72' ' ' ILE . 10.1 tp -128.92 129.75 68.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.52 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 74' ' ' ALA . 97.1 mt-10 40.95 41.84 1.35 Allowed 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.579 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.542 ' C ' ' H ' ' A' ' 76' ' ' SER . . . 56.82 117.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.349 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 46.0 p-10 -61.13 2.96 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.496 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.542 ' H ' ' C ' ' A' ' 74' ' ' ALA . 47.6 t -60.64 -45.55 93.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.746 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -96.02 -71.75 0.66 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.534 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.3 t -45.38 -91.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.471 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.581 ' O ' HG22 ' A' ' 82' ' ' ILE . 37.4 tt0 70.88 -49.04 0.67 Allowed 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.463 179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -69.36 -33.78 73.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.932 0.396 . . . . 0.0 110.871 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 81' ' ' ASP . 60.0 t0 -47.66 -32.0 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.634 -179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.581 HG22 ' O ' ' A' ' 79' ' ' GLN . 15.2 tt -61.39 -43.81 97.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.428 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.484 ' N ' HG23 ' A' ' 82' ' ' ILE . 96.6 mt -65.01 -43.54 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.138 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -50.7 -53.68 29.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.192 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -61.09 -42.08 97.85 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.827 0.346 . . . . 0.0 110.598 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 85.6 mt -60.32 -52.02 66.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.064 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.24 93.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.194 0.521 . . . . 0.0 110.294 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -54.96 -45.57 74.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.196 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 -65.22 -39.55 92.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.318 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mt -66.68 -37.97 85.84 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.422 179.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.82 -47.74 79.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.173 0.511 . . . . 0.0 110.19 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -62.12 -52.23 64.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -65.5 -27.49 41.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.355 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -64.1 -32.95 85.9 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.41 -44.4 92.86 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.578 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 47.4 p -161.62 89.54 0.75 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.917 0.389 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.5 mtm -60.94 -49.75 76.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.27 -179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.615 ' C ' ' H ' ' A' ' 100' ' ' SER . 67.8 t0 -176.85 123.81 0.15 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.312 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.6 mtm180 -55.41 1.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.639 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.615 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.6 t -59.59 -42.86 93.52 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.601 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.461 ' C ' ' O ' ' A' ' 100' ' ' SER . 3.0 pt -28.95 94.64 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.512 0 O-C-N 123.636 0.585 . . . . 0.0 110.925 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.456 ' O ' ' O ' ' A' ' 103' ' ' PRO . 70.9 Cg_exo -45.92 108.45 0.15 Allowed 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.246 1.964 . . . . 0.0 112.074 -178.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.456 ' O ' ' O ' ' A' ' 102' ' ' PRO . 60.3 Cg_exo -49.56 -170.47 0.0 OUTLIER 'Trans proline' 0 N--CA 1.493 1.489 0 C-N-CA 122.258 1.972 . . . . 0.0 112.132 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 91.13 -60.57 3.03 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.699 -0.961 . . . . 0.0 110.699 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.688 HD12 ' N ' ' A' ' 105' ' ' LEU . 7.5 mp -64.44 -43.01 95.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.042 0.449 . . . . 0.0 110.283 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 90.9 t -50.47 -41.7 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.946 -178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -57.72 -48.31 79.96 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.284 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.49 -51.1 58.65 Favored Glycine 0 CA--C 1.527 0.819 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 62.2 tp -62.92 -41.2 99.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.005 0.431 . . . . 0.0 110.121 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.69 -39.96 78.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.066 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.55 -44.29 96.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.516 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -68.01 -48.22 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.567 179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.6 tp -61.35 -23.06 65.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.627 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -74.13 -43.99 55.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.795 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -63.23 -41.55 99.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.922 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.5 t -97.24 35.08 1.65 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.348 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.515 ' C ' ' H ' ' A' ' 119' ' ' SER . 21.8 m -66.86 -14.62 62.92 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.38 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.8 ptt85 -71.25 16.95 0.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.71 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.515 ' H ' ' C ' ' A' ' 117' ' ' SER . 58.3 m 56.78 95.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.531 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -63.54 128.62 36.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.432 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -89.98 -3.27 58.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.302 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -78.44 45.59 0.58 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.665 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -103.92 -34.39 8.51 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.903 0.382 . . . . 0.0 110.569 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.44 ' C ' ' H ' ' A' ' 126' ' ' ASP . 28.8 t-20 -64.88 -37.64 88.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.659 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.464 ' O ' ' N ' ' A' ' 129' ' ' THR . 9.6 ptp180 -50.75 -12.09 0.1 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.796 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.44 ' H ' ' C ' ' A' ' 124' ' ' ASN . 93.7 m-20 -50.3 -49.12 54.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.807 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.552 ' N ' HD22 ' A' ' 127' ' ' LEU . 4.0 mm? -71.63 -43.45 66.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.041 0.448 . . . . 0.0 110.855 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.6 70.18 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.445 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.464 ' N ' ' O ' ' A' ' 125' ' ' ARG . 96.7 m -57.47 -51.49 69.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.356 -179.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.21 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.04 0.448 . . . . 0.0 110.604 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 14.9 mt -63.68 -47.02 82.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.411 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -56.2 -41.84 76.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.284 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 88.7 mm-40 -58.24 -45.46 87.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -65.8 -47.21 75.86 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.231 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 90.5 mt -63.37 -33.76 76.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.628 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -56.66 -31.71 64.67 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.114 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -134.23 61.66 1.67 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.76 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.481 ' O ' ' CD2' ' A' ' 138' ' ' TYR . 89.2 t80 -165.42 71.89 1.36 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.74 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.422 ' O ' ' O ' ' A' ' 140' ' ' ARG . 60.5 Cg_endo -80.13 -83.43 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.722 2.282 . . . . 0.0 112.127 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.422 ' O ' ' O ' ' A' ' 139' ' ' PRO . 77.9 mmt-85 59.94 126.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.68 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.549 ' O ' ' N ' ' A' ' 143' ' ' GLU . 99.6 m-20 -65.69 -34.14 77.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.799 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.8 mtm 61.24 -64.26 0.07 Allowed 'General case' 0 N--CA 1.463 0.196 0 O-C-N 123.803 0.69 . . . . 0.0 110.85 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.549 ' N ' ' O ' ' A' ' 141' ' ' ASP . 10.1 pt-20 -51.3 -46.35 62.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.424 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . 0.467 ' N ' ' CG ' ' A' ' 143' ' ' GLU . 88.1 tttt -62.88 -48.56 78.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.258 0.551 . . . . 0.0 109.985 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -55.82 -46.8 77.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.865 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 33.7 mtpt -65.98 -39.47 90.38 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.783 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 76.8 m -59.94 -47.8 84.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.749 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 74.1 mtm -61.4 -42.12 98.22 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.533 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.54 -43.33 85.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.809 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 64.6 t -67.97 -50.51 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.391 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.87 -44.2 96.74 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.001 0.429 . . . . 0.0 110.773 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.51 -37.74 88.48 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.19 -40.65 96.54 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.508 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.2 mt -60.7 -49.46 77.42 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.789 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.426 HD22 ' N ' ' A' ' 155' ' ' LEU . 4.1 mm? -65.32 -43.4 91.13 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.715 179.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -67.43 -42.9 82.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.343 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -67.52 -36.73 81.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.344 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.13 -41.97 97.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.551 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 75.5 t -63.62 -45.35 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.681 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -59.62 -51.15 71.06 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.119 -0.633 . . . . 0.0 110.01 -179.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . 0.44 ' O ' ' C ' ' A' ' 162' ' ' HIS . 17.5 t 35.02 -120.55 0.11 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.296 0.373 . . . . 0.0 110.631 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.44 ' C ' ' O ' ' A' ' 161' ' ' SER . 78.9 m-70 31.75 78.78 0.03 OUTLIER 'General case' 0 C--N 1.341 0.217 0 O-C-N 123.216 0.322 . . . . 0.0 111.555 178.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.547 HG21 ' HE ' ' A' ' 168' ' ' ARG . 17.9 m -129.61 80.58 71.51 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.237 -179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.97 149.88 67.78 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.904 2.403 . . . . 0.0 111.959 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 13.6 p -57.09 -169.01 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.763 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 21.8 tp 67.87 -51.45 0.52 Allowed 'General case' 0 C--O 1.233 0.212 0 O-C-N 123.897 0.748 . . . . 0.0 110.191 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 51.5 tp -60.08 -43.6 95.37 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.933 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.547 ' HE ' HG21 ' A' ' 163' ' ' THR . 99.8 mtt180 -66.59 -37.88 85.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.691 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -60.52 -47.0 88.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.72 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 80.8 t -68.37 -43.15 84.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.033 0.444 . . . . 0.0 110.298 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -58.4 -46.68 85.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.691 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . 0.403 ' CD2' ' O ' ' A' ' 168' ' ' ARG . 72.1 m-70 -65.03 -48.81 72.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.943 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -58.97 -45.92 89.35 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.4 m -53.35 -44.82 68.83 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.152 0.501 . . . . 0.0 110.214 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 79.0 t -59.73 -43.13 90.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.421 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -58.77 -39.71 81.81 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.47 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -60.05 -44.04 94.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.262 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 36.1 mm -64.04 -41.97 94.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.029 0.442 . . . . 0.0 110.537 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 180' ' ' GLN . 59.9 t-20 -49.89 -34.44 20.26 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.809 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.461 ' O ' ' O ' ' A' ' 179' ' ' ASN . 88.2 mt-30 -36.41 -96.71 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.798 0.332 . . . . 0.0 111.248 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -127.21 -15.24 5.26 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.901 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.539 HD12 ' N ' ' A' ' 182' ' ' LEU . 9.7 mp -64.65 -39.37 93.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.518 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -53.03 -32.69 48.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.613 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . 0.413 ' HA ' ' HE ' ' A' ' 187' ' ' ARG . 20.2 m -57.22 -47.67 80.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.962 0.411 . . . . 0.0 110.6 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 93.1 m-85 -67.55 -35.58 79.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.531 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 88.2 t -64.77 -43.9 96.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.549 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . 0.413 ' HE ' ' HA ' ' A' ' 184' ' ' THR . 87.8 mtm180 -60.34 -48.99 79.38 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.552 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 67.0 m -61.43 -42.36 98.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.851 0.358 . . . . 0.0 110.637 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 4.9 tp -99.26 39.48 1.29 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.578 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.31 -37.81 88.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.618 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 91.7 mtm180 -76.02 137.3 40.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.579 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 39.8 p30 -156.74 168.89 26.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.629 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -65.86 -40.09 95.34 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 46.0 ttp -61.69 -42.64 99.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.735 0.302 . . . . 0.0 110.433 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 25.0 t0 . . . . . 0 C--O 1.219 -0.529 0 CA-C-O 118.086 -0.959 . . . . 0.0 110.566 -179.915 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -90.7 5.66 47.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.787 0.327 . . . . 0.0 110.575 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -80.11 140.28 36.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.701 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.9 m -88.05 -3.96 58.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.319 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 58.6 m -58.45 -42.62 87.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.633 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -100.27 75.23 1.79 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.456 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 38.7 t -63.12 -43.79 97.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.512 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -88.82 138.43 31.42 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.705 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.7 mt -63.93 -41.88 97.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.465 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 145.39 -59.62 0.5 Allowed Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.428 ' O ' ' O ' ' A' ' 72' ' ' ILE . 43.4 ttm180 -66.53 -18.32 65.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.858 0.361 . . . . 0.0 110.373 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.567 ' C ' ' H ' ' A' ' 74' ' ' ALA . 7.9 mm -61.05 -127.78 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.197 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.3 tt0 67.83 -33.8 0.23 Allowed 'General case' 0 CA--C 1.529 0.164 0 O-C-N 123.482 0.489 . . . . 0.0 110.548 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.567 ' H ' ' C ' ' A' ' 72' ' ' ILE . . . -65.6 -36.57 84.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.613 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -87.96 11.52 15.64 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.416 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 98.8 p -58.46 -20.84 48.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.551 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -61.85 -72.75 0.11 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.606 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.1 t -62.61 -44.3 96.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.654 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -58.61 -8.39 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.567 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -62.23 -36.77 83.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.396 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -60.21 -48.29 82.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.432 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.3 mt -66.44 -43.68 90.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.447 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.31 -43.63 98.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.238 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 78.6 ttt-85 -56.09 -48.04 76.87 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -60.79 -42.74 98.18 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.038 0.447 . . . . 0.0 110.658 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 82.9 mt -60.52 -45.38 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.05 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.64 -39.04 93.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.119 0.485 . . . . 0.0 110.197 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -56.69 -48.62 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.906 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.24 -45.85 89.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.246 0.546 . . . . 0.0 110.49 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.522 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.1 mt -63.8 -39.41 94.18 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.462 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.479 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.39 -46.9 76.54 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.417 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 66.6 tp60 -64.53 -52.38 58.02 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.163 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.7 t -65.32 -25.96 38.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.392 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.522 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.16 -32.38 14.33 Favored Glycine 0 CA--C 1.526 0.777 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.404 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.479 ' N ' ' O ' ' A' ' 91' ' ' ALA . 64.7 t0 -70.69 -46.85 62.39 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 121.153 -0.219 . . . . 0.0 110.999 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.525 ' C ' ' H ' ' A' ' 98' ' ' ASP . 57.4 m -51.34 -105.93 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.815 0.34 . . . . 0.0 110.991 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 12.7 mmt 55.38 4.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.213 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.525 ' H ' ' C ' ' A' ' 96' ' ' SER . 98.1 m-20 -76.45 -67.11 0.72 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.344 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -90.09 -30.39 17.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.632 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.9 m -87.81 94.4 9.75 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.261 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -153.55 157.32 32.74 Favored Pre-proline 0 CA--C 1.533 0.298 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.979 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -82.1 162.0 17.97 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 C-N-CA 122.426 2.084 . . . . 0.0 112.653 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.613 ' C ' ' H ' ' A' ' 105' ' ' LEU . 54.1 Cg_exo -40.31 129.5 2.37 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 C-N-CA 122.895 2.396 . . . . 0.0 112.27 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -59.68 9.79 0.04 OUTLIER Glycine 0 CA--C 1.528 0.905 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.618 HD22 ' N ' ' A' ' 105' ' ' LEU . 3.7 mm? -67.46 -39.32 85.31 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.946 0.403 . . . . 0.0 110.288 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.61 HG13 ' N ' ' A' ' 107' ' ' ASN . 14.5 p -58.96 -48.44 86.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.405 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.61 ' N ' HG13 ' A' ' 106' ' ' VAL . 36.3 t30 -57.46 -34.37 68.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.361 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.79 -39.66 95.27 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 51.3 tp -60.43 -42.05 95.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.793 0.33 . . . . 0.0 110.695 -179.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.82 -48.8 80.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.149 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -69.06 -42.26 76.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.245 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -50.84 -37.54 43.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.79 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' A' ' 117' ' ' SER . 64.6 mt -62.33 -43.28 99.2 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.199 -0.6 . . . . 0.0 109.992 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -55.65 -41.95 74.34 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.0 110.03 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -63.2 -39.78 95.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.387 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.483 ' C ' ' H ' ' A' ' 118' ' ' ARG . 45.0 p -85.06 -10.51 56.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.755 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 113' ' ' LEU . 59.7 p -74.61 19.01 0.14 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.378 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.483 ' H ' ' C ' ' A' ' 116' ' ' THR . 16.7 ptm180 -60.64 -35.27 75.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.444 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 37.6 m -65.01 -21.87 66.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.877 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 26.8 tp10 73.42 -54.64 0.69 Allowed 'General case' 0 C--O 1.232 0.164 0 O-C-N 123.706 0.629 . . . . 0.0 110.382 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 56.2 25.96 9.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.938 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -97.67 2.01 49.29 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.47 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -64.94 -49.97 68.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.894 0.378 . . . . 0.0 110.501 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -69.37 -39.06 78.27 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.648 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.472 ' O ' ' HB3' ' A' ' 128' ' ' ALA . 71.5 ttt180 -59.87 -30.7 69.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.777 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 125' ' ' ARG . 33.8 t0 -37.12 -94.48 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.77 -178.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.892 HD22 ' N ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -49.23 -28.69 4.83 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.732 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.892 ' N ' HD22 ' A' ' 127' ' ' LEU . . . -56.58 -39.58 73.75 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 121.14 0.495 . . . . 0.0 109.971 -178.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 88.0 m -61.79 -42.37 98.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.311 -0.858 . . . . 0.0 109.697 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.5 -47.15 79.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.227 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -58.93 -44.91 91.45 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.385 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -67.06 -45.96 75.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.067 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -64.97 -37.0 86.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.78 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 56.6 tp -59.28 -54.49 46.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.362 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.77 -38.5 90.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.719 -179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -56.24 -31.95 64.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.435 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -134.92 94.24 3.13 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 110.366 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.572 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 72.4 t80 -155.14 44.51 0.23 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.882 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 58.8 Cg_endo -71.14 -14.69 31.9 Favored 'Trans proline' 0 N--CA 1.496 1.651 0 C-N-CA 122.762 2.308 . . . . 0.0 112.116 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -83.55 -175.5 5.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.57 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 20.4 t0 66.95 54.56 0.77 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.976 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . 0.459 ' CG ' ' N ' ' A' ' 143' ' ' GLU . 12.8 ptm -165.87 -43.44 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.384 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 142' ' ' MET . 81.4 tt0 -66.64 -42.87 86.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.021 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.59 -29.8 69.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.684 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -66.55 -50.31 63.58 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.605 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.443 ' O ' HG23 ' A' ' 150' ' ' VAL . 20.2 ptmt -72.85 -30.16 63.78 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.827 -0.545 . . . . 0.0 110.819 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 68.4 m -60.24 -46.22 90.52 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.314 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 66.4 mtt -64.91 -46.58 81.1 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.581 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.5 mp -66.09 -47.29 74.73 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.032 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 146' ' ' LYS . 57.0 t -62.51 -43.66 98.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.038 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.3 tp -53.12 -46.3 68.71 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.2 -179.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -63.33 -35.98 82.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.8 tp -59.25 -44.83 92.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.536 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.83 -44.41 96.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.048 0.451 . . . . 0.0 110.143 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 88.9 mt -65.3 -43.74 90.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.055 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.69 -44.99 69.3 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.686 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.427 ' O ' ' O ' ' A' ' 161' ' ' SER . 25.9 tptp -61.99 -40.59 96.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.572 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -62.39 -45.47 93.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.37 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.75 -43.99 82.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.687 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.94 -37.44 87.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.179 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . 0.427 ' O ' ' O ' ' A' ' 157' ' ' LYS . 41.1 t -172.36 176.84 3.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.275 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -128.2 142.67 51.1 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.829 0.347 . . . . 0.0 110.124 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.531 ' CB ' HH21 ' A' ' 168' ' ' ARG . 1.1 p -84.89 153.41 60.44 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.586 -179.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.22 -162.38 0.1 OUTLIER 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 122.592 2.195 . . . . 0.0 111.83 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 61.6 p -146.34 90.02 1.91 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.478 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 47.9 tp -174.15 -70.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.492 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 55.1 mt -64.5 -26.97 68.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.307 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.531 HH21 ' CB ' ' A' ' 163' ' ' THR . 63.1 ttm-85 -60.06 -45.59 92.35 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.24 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.79 -46.03 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.935 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 75.6 t -63.22 -45.3 98.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.438 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -61.12 -38.23 85.61 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.095 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -59.75 -46.83 87.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.591 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.7 m -61.24 -46.99 88.1 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.6 m -52.59 -43.71 65.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.446 -178.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 72.1 t -62.69 -43.41 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.292 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . 0.444 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 54.7 t-20 -71.77 -32.56 67.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.292 0.568 . . . . 0.0 110.649 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -58.94 -43.34 91.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.553 -179.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.35 -42.61 96.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.583 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.441 ' HA ' HH12 ' A' ' 183' ' ' ARG . 93.9 m-20 -51.49 -34.18 34.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.647 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.49 ' O ' ' ND2' ' A' ' 181' ' ' ASN . 59.4 tt0 -36.66 -93.84 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.628 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . 0.49 ' ND2' ' O ' ' A' ' 180' ' ' GLN . 16.2 m120 -151.45 4.64 0.44 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.124 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 186' ' ' VAL . 10.9 mp -48.55 -36.52 15.6 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.595 0.236 . . . . 0.0 110.626 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . 0.441 HH12 ' HA ' ' A' ' 179' ' ' ASN . 90.1 mtm-85 -51.75 -49.71 62.07 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.342 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 96.7 m -66.78 -49.65 65.21 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.106 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -62.3 -43.89 97.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.704 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 182' ' ' LEU . 46.8 t -59.59 -42.97 89.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.005 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -56.2 -53.88 51.91 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.097 -0.641 . . . . 0.0 109.797 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 9.9 p -62.83 -41.47 99.35 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.591 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.504 HD22 ' N ' ' A' ' 189' ' ' LEU . 4.2 mm? -89.15 -172.2 3.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.345 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . 56.19 55.99 6.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.36 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -62.85 -44.13 96.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.455 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -82.28 157.08 23.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.549 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -170.37 172.14 43.9 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 50.1 ttp -135.2 146.71 48.95 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.901 0.381 . . . . 0.0 110.413 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 34.5 t70 . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.496 -179.947 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.2 m120 57.88 34.45 24.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.949 0.404 . . . . 0.0 110.479 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 63' ' ' ARG . 1.4 tpm_? 45.43 85.3 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.037 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 97.9 p -156.14 163.01 40.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.604 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 96.9 p -160.04 164.9 32.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.403 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -111.56 143.74 41.93 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.414 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 68.5 m -75.07 151.87 38.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.644 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 67.8 ttp85 -81.66 140.5 34.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.535 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.564 HD12 ' N ' ' A' ' 69' ' ' LEU . 10.5 mp -95.58 111.65 23.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.985 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -92.28 -100.8 1.39 Allowed Glycine 0 CA--C 1.521 0.421 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -83.28 124.94 31.08 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 70.5 mt -94.64 97.01 6.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.21 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 39.47 60.23 1.62 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.887 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.469 ' O ' ' N ' ' A' ' 76' ' ' SER . . . 50.66 -138.68 0.99 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.273 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 46.65 15.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.668 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 74' ' ' ALA . 90.1 p -110.59 8.55 22.88 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.472 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.54 ' N ' ' OE1' ' A' ' 77' ' ' GLU . 55.1 mp0 -98.93 -1.11 40.8 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.581 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.9 t -156.58 46.8 0.44 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.704 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -172.85 -73.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.36 -35.55 81.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.187 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -61.61 -41.52 97.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.493 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.429 ' O ' HD13 ' A' ' 86' ' ' ILE . 22.1 mm -62.06 -49.06 85.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.104 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.6 -42.53 94.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.167 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -51.46 -54.59 25.34 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.882 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -53.89 -44.02 70.11 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.944 0.402 . . . . 0.0 110.912 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 82' ' ' ILE . 1.5 mp -63.4 -49.88 80.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 120.288 -0.565 . . . . 0.0 109.511 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.483 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -60.37 -37.69 81.53 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.948 -179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -58.56 -47.19 85.05 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.561 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -68.88 -46.98 67.0 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.223 0.535 . . . . 0.0 110.854 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.5 mp -67.71 -35.47 78.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.771 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.483 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -64.1 -42.74 96.78 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.408 ' NE2' ' C ' ' A' ' 92' ' ' GLN . 0.6 OUTLIER -64.05 -52.72 58.08 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.509 -179.572 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.3 p -73.67 -27.09 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.216 0.531 . . . . 0.0 110.363 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -78.37 -35.8 32.36 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 -179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -63.74 -47.05 82.58 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.788 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.9 m -163.48 143.59 8.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.34 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.6 ttm -72.41 98.44 2.25 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.286 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.452 ' O ' ' CB ' ' A' ' 99' ' ' ARG . 66.4 t0 41.75 42.59 2.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.317 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.452 ' CB ' ' O ' ' A' ' 98' ' ' ASP . 7.9 tpt180 80.07 -74.18 0.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.307 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.418 ' C ' HD12 ' A' ' 101' ' ' ILE . 5.7 p 176.55 84.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.749 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.699 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 1.4 mp -94.06 -30.38 0.29 Allowed Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.548 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.699 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 37.4 Cg_exo -57.51 166.4 4.82 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 C-N-CA 122.15 1.9 . . . . 0.0 111.844 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.509 ' C ' ' H ' ' A' ' 105' ' ' LEU . 75.3 Cg_exo -47.3 163.64 0.15 Allowed 'Trans proline' 0 C--N 1.307 -1.606 0 C-N-CA 122.437 2.092 . . . . 0.0 112.266 178.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -60.45 1.26 0.72 Allowed Glycine 0 CA--C 1.527 0.813 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' A' ' 103' ' ' PRO . 59.6 mt -62.28 -38.89 91.08 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.766 0.317 . . . . 0.0 110.525 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 99.3 t -61.21 -45.1 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.215 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -62.7 -41.4 99.1 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.484 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.92 -21.94 11.2 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.7 mt -61.53 -40.05 93.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.77 0.319 . . . . 0.0 110.579 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.14 -44.79 44.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.679 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.545 HD22 ' N ' ' A' ' 111' ' ' LEU . 3.9 mm? -65.67 -34.73 78.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.928 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -69.03 -47.16 66.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.388 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.3 tp -63.99 -42.92 97.04 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.225 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 62.6 ttm-85 -63.03 -46.2 88.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.195 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -70.81 -40.63 72.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.677 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.2 m -92.86 18.3 9.21 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.4 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.9 p -62.2 -20.28 64.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.463 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -62.92 -30.61 71.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.674 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.4 m -63.88 -105.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.545 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -174.01 -57.81 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.491 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 64.36 40.88 6.17 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.461 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -111.01 10.67 22.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.059 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -59.67 -44.47 93.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.086 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -66.37 -41.64 89.18 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.103 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 -80.26 -4.24 52.48 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.378 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -42.27 -67.89 0.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 49.2 mt -66.0 -40.46 91.16 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 120.796 0.332 . . . . 0.0 111.149 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -38.72 66.32 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.494 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 55.8 m -72.91 -42.77 63.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.75 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.81 -47.02 87.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.079 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.9 -47.12 86.4 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.83 0.348 . . . . 0.0 110.716 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -55.07 -41.12 71.09 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.18 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -67.92 -38.47 82.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.661 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.7 tp -59.74 -54.46 46.06 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.595 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.495 ' N ' HD12 ' A' ' 135' ' ' LEU . 8.2 mp -65.32 -40.26 93.51 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.012 0.434 . . . . 0.0 110.614 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . 0.664 ' NE2' HH22 ' A' ' 140' ' ' ARG . 82.0 mm-40 -66.93 -33.22 75.1 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.341 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -60.07 -50.89 71.94 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.039 -179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.55 ' CE2' ' O ' ' A' ' 139' ' ' PRO . 0.1 OUTLIER -109.37 150.56 41.28 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.763 -179.403 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.55 ' O ' ' CE2' ' A' ' 138' ' ' TYR . 55.9 Cg_endo -72.26 156.62 54.87 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.405 2.07 . . . . 0.0 111.584 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.664 HH22 ' NE2' ' A' ' 136' ' ' GLN . 0.6 OUTLIER -94.26 8.13 42.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.412 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -63.07 129.59 41.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.238 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.9 mtt -116.73 3.81 13.02 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.336 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -63.61 -34.81 78.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.785 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -60.9 -38.09 84.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.006 0.431 . . . . 0.0 110.241 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -62.04 -45.55 93.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.424 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.489 ' O ' HG23 ' A' ' 150' ' ' VAL . 99.1 mttt -66.92 -32.94 74.54 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.556 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 19.3 m -58.92 -45.46 90.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.259 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.7 mtt -63.16 -45.98 89.32 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.658 -0.417 . . . . 0.0 109.954 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.95 -42.65 80.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 146' ' ' LYS . 42.9 t -62.71 -43.17 98.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.285 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 48.2 tp -59.27 -47.49 85.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.429 -179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.6 -41.99 87.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.181 0.515 . . . . 0.0 109.728 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 5.6 tp -59.08 -40.77 86.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.168 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 29.1 mt -61.22 -44.73 96.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.966 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.7 -46.45 82.32 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.181 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.41 -41.18 96.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.15 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 57.4 mmtt -63.38 -38.94 93.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.301 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -58.17 -42.32 85.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.717 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.5 t -65.59 -46.07 90.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.281 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -69.1 -32.89 72.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.047 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 11.3 t -31.39 94.7 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.124 0.488 . . . . 0.0 110.996 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.511 ' CG ' ' O ' ' A' ' 161' ' ' SER . 89.2 m-70 -159.83 41.91 0.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.151 -179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.544 ' N ' ' CD ' ' A' ' 164' ' ' PRO . 0.5 OUTLIER -128.25 48.12 3.26 Favored Pre-proline 0 N--CA 1.466 0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.351 179.507 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 163' ' ' THR . 36.4 Cg_endo -66.1 140.71 60.73 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.503 2.136 . . . . 0.0 111.738 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 1.4 m 162.03 -177.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.432 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.546 ' N ' HD22 ' A' ' 166' ' ' LEU . 3.8 mm? -77.55 -10.76 59.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.554 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.598 ' C ' HD12 ' A' ' 167' ' ' LEU . 1.6 pp -61.6 -27.52 68.71 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.466 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -62.09 -47.09 86.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . 0.4 ' OD1' ' O ' ' A' ' 169' ' ' ASP . 66.7 t0 -66.71 -38.71 87.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.54 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 84.8 t -61.95 -46.51 96.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.586 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -61.21 -41.3 96.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.837 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -59.95 -49.71 76.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.501 -179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 85.2 m -60.07 -42.47 94.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.837 0.351 . . . . 0.0 110.547 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.2 m -56.31 -43.19 78.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.435 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 77.0 t -61.33 -43.13 96.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.542 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -67.65 -41.79 83.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.797 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . 0.467 ' O ' ' O ' ' A' ' 180' ' ' GLN . 4.7 m-85 -64.26 -36.15 83.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.541 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 2.5 mm -54.91 -35.68 35.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.483 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -55.25 -53.76 51.99 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.577 -178.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.467 ' O ' ' O ' ' A' ' 177' ' ' PHE . 99.1 mt-30 -100.9 138.31 38.13 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.392 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 71.1 50.47 0.31 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.322 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 53.9 tp -67.4 -41.02 85.64 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.739 179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -56.73 -32.78 65.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.415 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 69.3 m -61.0 -49.07 78.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.891 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -68.91 -42.22 77.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.027 0.441 . . . . 0.0 110.316 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 73.3 t -62.98 -42.69 97.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.682 179.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -58.95 -44.73 91.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.298 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.3 t -61.23 -44.48 97.2 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 120.775 0.321 . . . . 0.0 110.518 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 50.8 tp -63.27 -43.58 97.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.55 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . 0.541 ' O ' ' N ' ' A' ' 192' ' ' ASN . . . -72.95 -70.46 0.35 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.481 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 41.19 -88.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.795 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.541 ' N ' ' O ' ' A' ' 190' ' ' ALA . 40.4 t30 -63.41 -41.23 98.71 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.434 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . 0.531 ' O ' ' N ' ' A' ' 195' ' ' ASP . . . 57.3 30.19 61.04 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 43.7 ttm 57.21 -78.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.761 0.315 . . . . 0.0 110.488 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . 0.531 ' N ' ' O ' ' A' ' 193' ' ' GLY . 54.9 p-10 . . . . . 0 C--O 1.219 -0.527 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.463 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -85.58 114.19 22.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.827 0.346 . . . . 0.0 110.265 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 73.7 ttp85 -126.55 127.94 46.08 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.087 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.2 m 40.03 72.03 0.16 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.896 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.6 t -61.56 -43.27 99.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.442 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.485 ' CG ' ' N ' ' A' ' 67' ' ' SER . 86.0 t60 -153.04 160.93 43.02 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.518 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.485 ' N ' ' CG ' ' A' ' 66' ' ' HIS . 29.2 p -157.14 165.23 36.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.739 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -68.87 138.67 54.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.441 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.533 HD23 ' C ' ' A' ' 69' ' ' LEU . 3.2 tt -145.02 96.55 2.87 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.445 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -103.1 -178.8 26.43 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 5.8 tpt180 48.92 82.72 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.705 0.288 . . . . 0.0 110.621 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.716 HG23 ' O ' ' A' ' 72' ' ' ILE . 19.0 tt -137.72 76.89 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.593 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.512 ' N ' ' OE1' ' A' ' 73' ' ' GLU . 57.5 mp0 40.38 21.86 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.756 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.531 ' N ' ' O ' ' A' ' 72' ' ' ILE . . . -167.36 161.23 14.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.484 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 55.31 16.12 1.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.745 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 59.7 p -91.36 -4.59 55.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.175 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -54.16 -35.64 62.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.377 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.0 m -126.72 -160.99 1.03 Allowed 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.347 -0.388 . . . . 0.0 109.956 179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? 70.92 -56.52 0.62 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.897 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -65.22 -33.82 76.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.0 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -58.48 -45.4 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.525 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 93.5 mt -63.46 -43.77 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.408 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.7 mt -62.41 -43.36 98.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 76.8 ttt-85 -53.46 -53.18 55.09 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -58.1 -42.37 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.699 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.54 -51.59 68.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.011 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -61.81 -38.2 87.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.338 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -55.96 -47.51 77.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.607 -179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -66.23 -45.17 81.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.164 0.507 . . . . 0.0 110.826 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.451 ' O ' ' N ' ' A' ' 94' ' ' GLY . 8.3 mt -68.44 -33.6 74.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.471 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.46 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -58.78 -46.48 87.45 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.132 -179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.32 -51.99 60.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.077 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.39 -26.16 38.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -87.17 -22.96 42.59 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -63.13 -43.85 97.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.703 0.287 . . . . 0.0 111.077 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.582 ' C ' ' H ' ' A' ' 98' ' ' ASP . 32.7 t -165.83 -75.88 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.581 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.9 tpt 66.67 -14.25 0.16 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.358 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.582 ' H ' ' C ' ' A' ' 96' ' ' SER . 95.1 m-20 -72.03 -19.45 61.85 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.219 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -68.89 -41.22 78.59 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.68 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 77.0 p -63.7 -42.96 97.9 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.731 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.469 ' O ' ' O ' ' A' ' 98' ' ' ASP . 38.9 mt -110.93 129.56 23.84 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.943 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.509 ' O ' ' N ' ' A' ' 104' ' ' GLY . 73.0 Cg_endo -74.04 161.32 41.29 Favored 'Trans proline' 0 N--CA 1.493 1.458 0 C-N-CA 122.383 2.055 . . . . 0.0 112.512 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.498 ' O ' ' N ' ' A' ' 105' ' ' LEU . 85.2 Cg_exo -39.2 -22.37 0.08 OUTLIER 'Trans proline' 0 C--N 1.311 -1.447 0 C-N-CA 122.826 2.35 . . . . 0.0 112.077 178.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.569 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . 44.3 17.86 0.09 OUTLIER Glycine 0 CA--C 1.521 0.455 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.498 ' N ' ' O ' ' A' ' 103' ' ' PRO . 10.9 mp 58.64 -4.25 0.07 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.539 0.209 . . . . 0.0 110.484 -179.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.569 ' H ' ' C ' ' A' ' 104' ' ' GLY . 69.2 t -64.92 -45.79 93.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.947 0.403 . . . . 0.0 110.249 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -64.22 -32.19 73.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.999 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -61.6 -35.25 90.86 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 96.4 mt -62.03 -38.29 88.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.934 0.397 . . . . 0.0 110.539 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -56.97 -47.56 80.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.385 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 111' ' ' LEU . 5.1 tt -65.53 -46.24 80.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.586 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -50.86 -36.35 37.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.647 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.494 ' O ' ' N ' ' A' ' 117' ' ' SER . 80.4 mt -61.49 -42.98 99.61 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.234 -0.586 . . . . 0.0 109.663 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -56.5 -42.54 78.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.968 0.413 . . . . 0.0 110.151 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -62.86 -37.84 88.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.305 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.524 ' C ' ' H ' ' A' ' 118' ' ' ARG . 46.1 p -88.6 -12.52 42.38 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.755 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.494 ' N ' ' O ' ' A' ' 113' ' ' LEU . 83.5 p -70.83 34.11 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.666 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.524 ' H ' ' C ' ' A' ' 116' ' ' THR . 35.7 mmt180 -64.01 -35.68 81.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.211 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.509 ' C ' ' H ' ' A' ' 121' ' ' GLU . 52.8 p -67.33 8.86 0.27 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.683 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.52 ' H ' ' C ' ' A' ' 118' ' ' ARG . 55.9 mm-40 68.11 -42.81 0.47 Allowed 'General case' 0 C--O 1.231 0.094 0 O-C-N 123.58 0.55 . . . . 0.0 110.441 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.509 ' H ' ' C ' ' A' ' 119' ' ' SER . 95.7 mt-10 56.83 2.63 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.385 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.53 ' OD1' ' NH2' ' A' ' 125' ' ' ARG . 16.4 m-20 -127.87 -2.54 5.91 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.306 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -62.52 -41.45 98.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.619 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.552 ' C ' ' H ' ' A' ' 126' ' ' ASP . 7.3 m120 -66.3 -66.35 0.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.964 -179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.53 ' NH2' ' OD1' ' A' ' 122' ' ' ASP . 15.6 ptt180 -62.92 7.8 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.845 179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.552 ' H ' ' C ' ' A' ' 124' ' ' ASN . 65.7 t0 -62.45 -38.83 91.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.706 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.586 ' N ' HD22 ' A' ' 127' ' ' LEU . 3.6 mm? -71.49 -42.96 67.42 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 121.141 0.496 . . . . 0.0 111.16 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.85 -28.73 69.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.567 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 125' ' ' ARG . 6.0 m -60.42 -49.85 75.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.154 -179.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.14 -45.65 90.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.29 -41.99 96.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.644 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -55.33 -45.02 76.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.138 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.6 mt-30 -61.91 -47.05 86.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.726 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 53.4 tp -64.5 -49.12 72.58 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.456 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.599 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.08 -31.95 67.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.231 0.539 . . . . 0.0 110.214 -178.125 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.91 -25.76 44.42 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.681 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -108.68 -114.15 0.29 Allowed 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 29.3 t80 64.23 59.32 1.64 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.95 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.451 ' O ' ' O ' ' A' ' 140' ' ' ARG . 60.9 Cg_endo -75.48 -10.28 20.4 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 C-N-CA 122.538 2.158 . . . . 0.0 110.845 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 139' ' ' PRO . 92.9 mtt180 -51.38 -171.87 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.523 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 56.57 48.56 16.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.667 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 64.4 mtt -144.6 -63.15 0.36 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.748 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -65.23 -44.6 87.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.009 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.13 -34.15 77.72 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.148 -179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -64.92 -43.32 93.17 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.069 0.462 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 150' ' ' VAL . 51.7 mtmt -66.46 -36.18 82.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.582 179.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 58.5 m -58.56 -43.77 89.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.262 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mmm -61.36 -46.56 89.72 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.356 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.8 mp -67.0 -43.82 81.91 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.122 0.487 . . . . 0.0 110.673 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 146' ' ' LYS . 47.1 t -60.68 -45.28 97.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.563 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 36.3 mt -58.13 -45.66 86.95 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.434 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.85 -40.43 91.72 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.389 -0.525 . . . . 0.0 110.079 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.23 -45.28 84.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.267 -178.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -61.54 -44.04 97.77 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.746 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.598 ' O ' HD23 ' A' ' 155' ' ' LEU . 4.0 tt -65.08 -51.66 60.14 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 119.979 -0.688 . . . . 0.0 110.031 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -63.68 -41.87 98.1 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.758 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -63.79 -36.73 84.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.311 179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -62.32 -39.36 92.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.385 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.9 t -67.89 -49.47 68.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.668 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.483 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -70.89 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.325 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . 0.513 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 38.5 t -24.7 90.54 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.812 0.695 . . . . 0.0 111.186 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.513 ' CG ' ' O ' ' A' ' 161' ' ' SER . 70.3 m-70 -160.74 38.25 0.16 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.423 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 2.9 p -101.26 150.41 37.13 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.631 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -71.63 166.08 30.54 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 C-N-CA 122.807 2.338 . . . . 0.0 111.782 179.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 41.3 t -108.58 100.87 10.07 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.645 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 58.2 tp -172.74 -80.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.535 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 62.0 mt -62.4 -25.93 68.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.371 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -60.59 -45.45 93.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.099 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -65.48 -42.02 92.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.583 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 83.6 t -62.3 -44.64 99.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.325 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.17 -40.61 81.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -60.69 -44.48 96.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.418 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 11.9 m -64.89 -40.24 94.78 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.795 0.331 . . . . 0.0 110.618 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 93.7 m -58.35 -50.74 72.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.984 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.9 -33.36 61.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.584 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 38.5 t-20 -71.34 -39.7 71.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.062 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -61.84 -39.72 92.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.721 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 93.7 mt -59.92 -41.56 86.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.563 -179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 180' ' ' GLN . 95.7 m-20 -49.57 -34.13 16.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.006 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.432 ' O ' ' O ' ' A' ' 179' ' ' ASN . 99.0 mm-40 -38.01 -95.96 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.029 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -128.73 -16.76 4.16 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.984 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 182' ' ' LEU . 9.8 mp -62.55 -36.41 82.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.796 0.332 . . . . 0.0 110.191 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -51.79 -43.72 63.15 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.471 -177.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 97.1 m -61.86 -52.25 64.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.81 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -66.65 -41.65 87.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.004 0.431 . . . . 0.0 110.965 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 182' ' ' LEU . 74.6 t -64.19 -43.44 97.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.554 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 56.6 mmt-85 -57.68 -52.52 65.11 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.449 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 57.1 m -58.48 -49.04 78.77 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.701 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.482 ' C ' ' H ' ' A' ' 191' ' ' ARG . 49.2 tp -176.57 149.61 0.8 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.425 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -70.21 10.61 0.42 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.358 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . 0.482 ' H ' ' C ' ' A' ' 189' ' ' LEU . 78.4 ttt-85 -66.74 136.25 55.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.35 179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -88.44 160.01 17.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.272 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -65.85 131.05 33.87 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . 0.443 ' C ' ' SD ' ' A' ' 194' ' ' MET . 1.3 tmt? -148.98 120.89 8.18 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.735 0.302 . . . . 0.0 110.444 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.517 179.885 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 22.2 p30 -154.81 170.88 20.6 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.752 0.311 . . . . 0.0 110.576 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 49.29 75.09 0.16 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.596 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.9 m -69.92 144.94 52.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.528 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.0 p -158.2 162.13 37.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.583 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 44.25 88.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.654 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.6 p -74.45 162.77 28.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.616 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 80.0 mtp85 -74.18 144.73 44.67 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.72 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 32.4 tp -154.67 73.28 0.89 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.243 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.06 -40.97 93.15 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -87.02 133.44 33.58 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.794 0.33 . . . . 0.0 110.477 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.432 ' O ' ' OD1' ' A' ' 75' ' ' ASP . 8.9 mt -143.04 -64.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.452 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -68.01 -36.41 79.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.635 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.2 -48.95 77.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.625 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.501 ' N ' ' OD1' ' A' ' 75' ' ' ASP . 17.8 p-10 -91.49 -112.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.537 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.44 ' O ' ' OG ' ' A' ' 76' ' ' SER . 10.9 t 54.12 22.68 3.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.632 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.449 ' C ' ' H ' ' A' ' 79' ' ' GLN . 79.1 tt0 -160.09 89.01 0.84 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.363 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.6 t 70.43 -43.25 0.54 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.933 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.449 ' H ' ' C ' ' A' ' 77' ' ' GLU . 82.7 mt-30 -63.58 -37.2 86.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.372 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -60.31 -36.77 78.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -61.33 -49.71 75.9 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.875 0.369 . . . . 0.0 110.661 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 94.3 mt -64.54 -43.2 96.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.284 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.03 -43.27 97.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.787 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 63.7 ttm-85 -53.43 -53.69 47.63 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -58.0 -44.0 86.97 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 121.031 0.443 . . . . 0.0 110.632 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 93.1 mt -61.43 -50.47 80.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.563 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.09 -39.92 83.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.515 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 62.1 ttt85 -54.4 -45.71 72.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.034 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -63.31 -44.62 94.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.484 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.2 mt -64.66 -39.25 93.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.558 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.85 -44.56 74.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.117 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -64.51 -51.77 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.31 179.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 43.9 t -64.27 -26.29 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.665 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.11 -19.79 56.64 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -62.74 -46.88 86.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.775 0.321 . . . . 0.0 110.536 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 67.0 m -77.41 -69.87 0.51 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.865 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.4 ttp -76.93 -177.66 4.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.13 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 55.75 36.37 27.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.764 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -105.81 2.04 27.44 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.643 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m -154.81 -1.95 0.16 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.933 0.397 . . . . 0.0 110.883 -179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.669 ' N ' ' CD ' ' A' ' 102' ' ' PRO . 1.4 mp -94.73 -30.19 0.28 Allowed Pre-proline 0 CA--C 1.538 0.511 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.138 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.669 ' CD ' ' N ' ' A' ' 101' ' ' ILE . 87.9 Cg_exo -44.97 105.0 0.06 OUTLIER 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 121.788 1.659 . . . . 0.0 112.333 -178.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.509 ' O ' ' O ' ' A' ' 102' ' ' PRO . 54.1 Cg_exo -52.54 -135.6 0.0 OUTLIER 'Trans proline' 0 N--CA 1.503 2.033 0 C-N-CA 122.433 2.088 . . . . 0.0 112.357 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 79.11 16.82 77.99 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.3 pp -148.49 -40.12 0.16 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.815 0.34 . . . . 0.0 110.579 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.515 HG23 ' N ' ' A' ' 107' ' ' ASN . 35.7 m -64.17 -43.75 97.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.271 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.515 ' N ' HG23 ' A' ' 106' ' ' VAL . 27.2 t-20 -64.62 -50.56 66.68 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.294 -0.562 . . . . 0.0 109.966 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -63.08 -31.44 80.72 Favored Glycine 0 CA--C 1.522 0.507 0 N-CA-C 110.739 -0.945 . . . . 0.0 110.739 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 50.3 tp -60.6 -48.45 81.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -47.74 84.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.443 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.55 HD13 ' O ' ' A' ' 111' ' ' LEU . 0.2 OUTLIER -64.22 -45.75 86.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.123 -179.299 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.44 ' O ' ' OD1' ' A' ' 115' ' ' ASN . 58.1 tt0 -61.73 -35.31 77.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.031 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.2 tp -64.23 -33.42 75.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.392 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . 0.453 ' C ' ' N ' ' A' ' 116' ' ' THR . 61.3 ttp180 -60.0 -40.76 90.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.741 -179.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 116' ' ' THR . 33.1 p-10 -48.82 -13.96 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.668 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.454 ' N ' ' OD1' ' A' ' 115' ' ' ASN . 99.5 m -61.42 -46.5 89.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.692 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.524 ' O ' ' N ' ' A' ' 119' ' ' SER . 29.0 p -79.27 -52.87 7.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.632 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' A' ' 117' ' ' SER . 30.9 ptt180 33.71 31.05 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.224 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.524 ' N ' ' O ' ' A' ' 117' ' ' SER . 47.1 m -122.04 -11.43 8.48 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.66 -179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -89.39 -10.89 44.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.911 0.386 . . . . 0.0 110.515 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -68.72 -38.75 80.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.08 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 36.3 p30 -87.42 0.08 56.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.627 -179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -68.11 -42.98 79.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.007 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.533 ' C ' ' H ' ' A' ' 126' ' ' ASP . 97.7 m-20 -136.01 -33.23 0.85 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.648 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.59 15.95 0.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.313 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.533 ' H ' ' C ' ' A' ' 124' ' ' ASN . 39.2 t70 -80.83 -76.63 0.23 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.796 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.5 pp -59.75 -31.66 69.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.702 0.286 . . . . 0.0 110.837 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.14 -40.35 70.47 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.18 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 27.0 m -60.79 -50.7 72.41 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.102 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.5 73.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.245 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 31.3 tp -59.64 -46.23 89.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.137 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.0 tp10 -70.28 -47.93 59.01 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.625 -0.43 . . . . 0.0 109.991 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -59.82 -43.55 94.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.671 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 5.7 tt -64.14 -41.27 97.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.978 0.418 . . . . 0.0 110.703 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -27.69 46.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.229 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -55.4 -25.24 34.58 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.023 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -115.72 -107.22 0.38 Allowed 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.524 ' OH ' ' NH1' ' A' ' 140' ' ' ARG . 76.3 t80 57.37 64.65 4.1 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.9 0.381 . . . . 0.0 110.673 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.429 ' O ' ' O ' ' A' ' 140' ' ' ARG . 62.9 Cg_endo -77.47 -50.14 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.378 2.052 . . . . 0.0 111.75 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.524 ' NH1' ' OH ' ' A' ' 138' ' ' TYR . 56.2 ttp180 55.59 162.42 0.02 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.605 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.592 ' O ' ' N ' ' A' ' 144' ' ' LYS . 45.9 t0 -47.72 -45.17 28.44 Favored 'General case' 0 C--O 1.224 -0.281 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . 0.45 ' C ' ' O ' ' A' ' 141' ' ' ASP . 39.0 ttm -28.09 -48.34 0.05 Allowed 'General case' 0 N--CA 1.473 0.707 0 O-C-N 123.408 0.442 . . . . 0.0 111.143 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -66.06 -48.09 72.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.282 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . 0.592 ' N ' ' O ' ' A' ' 141' ' ' ASP . 39.3 ttmt -63.69 -36.46 83.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.143 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -71.32 -45.95 61.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.882 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -57.78 -49.45 76.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.419 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 3.5 m -64.41 -50.24 68.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.007 0.432 . . . . 0.0 110.514 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 21.8 ttp -62.13 -34.88 77.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.65 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 46.1 tp -59.67 -48.25 82.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.188 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.52 -43.96 95.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.568 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 56.7 tp -61.38 -45.88 92.54 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.379 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.55 -32.92 73.0 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.405 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.4 tp -66.47 -39.39 88.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.43 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 37.6 mt -61.51 -45.83 92.55 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.466 -178.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.421 HD22 ' N ' ' A' ' 155' ' ' LEU . 4.1 mm? -65.95 -39.81 90.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.681 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.22 -42.19 66.01 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.526 179.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -66.72 -41.78 87.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.689 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -61.49 -45.32 94.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.575 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 69.5 t -63.42 -44.89 99.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.38 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.48 -39.23 92.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.832 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 47.0 m -164.89 164.37 20.86 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -122.04 134.61 54.79 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . 0.475 ' OG1' ' NH2' ' A' ' 168' ' ' ARG . 0.5 OUTLIER -90.24 157.3 45.34 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-O 120.641 0.257 . . . . 0.0 110.541 -179.371 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 163' ' ' THR . 76.3 Cg_exo -42.19 170.05 0.01 OUTLIER 'Trans proline' 0 N--CA 1.49 1.297 0 C-N-CA 122.411 2.074 . . . . 0.0 111.959 178.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 79.9 p -119.82 15.91 12.64 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.623 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 54.7 tp -127.2 -45.12 1.55 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.712 0.291 . . . . 0.0 110.645 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.503 HD12 ' N ' ' A' ' 167' ' ' LEU . 10.8 mp -59.88 -39.81 86.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.05 -179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.475 ' NH2' ' OG1' ' A' ' 163' ' ' THR . 9.7 ptp180 -71.17 -34.44 70.95 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.608 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . 0.493 ' O ' HG23 ' A' ' 173' ' ' THR . 91.3 m-20 -62.31 -46.89 86.72 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.96 -179.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.449 ' O ' ' OG1' ' A' ' 173' ' ' THR . 7.5 p -69.97 -33.28 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.133 0.492 . . . . 0.0 110.119 179.152 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -59.16 -46.28 88.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.115 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -65.32 -42.24 93.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . 0.493 HG23 ' O ' ' A' ' 169' ' ' ASP . 51.9 p -58.21 -46.09 86.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.348 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.8 m -59.63 -44.63 93.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.917 0.389 . . . . 0.0 110.341 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.79 -44.28 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.481 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -56.93 -40.96 77.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.334 -179.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -62.31 -45.26 94.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.33 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.1 mt -62.83 -43.51 98.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.095 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -49.54 -34.86 18.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.31 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -93.18 141.63 28.2 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 8.0 m120 59.13 41.68 20.05 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.507 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER -61.87 -44.46 96.77 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.269 -179.245 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -59.11 -37.58 77.52 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.209 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 16.0 m -60.55 -46.99 88.15 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.392 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -64.0 -35.59 81.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 190' ' ' ALA . 62.0 t -59.82 -45.62 94.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.213 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -62.45 -49.9 73.58 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.691 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.5 t -59.96 -41.68 92.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.442 -179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.51 HD22 ' N ' ' A' ' 189' ' ' LEU . 3.8 mm? -93.21 4.23 54.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.687 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . 0.506 ' O ' ' N ' ' A' ' 192' ' ' ASN . . . -39.58 -70.62 0.1 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.71 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 40.5 -92.35 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.728 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.506 ' N ' ' O ' ' A' ' 190' ' ' ALA . 11.3 m120 -63.04 -40.98 99.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.36 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' A' ' 190' ' ' ALA . . . 84.22 100.63 0.6 Allowed Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 28.3 ttt -63.48 -41.51 98.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.766 0.317 . . . . 0.0 110.52 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 53.9 p-10 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.98 -1.009 . . . . 0.0 110.443 179.894 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 63.4 t-20 -85.92 108.47 18.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.814 0.34 . . . . 0.0 110.394 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -132.77 143.33 49.51 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.315 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 88.7 p -159.75 163.49 34.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.309 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.4 m -132.15 163.03 29.42 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.286 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -143.78 151.81 40.44 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.279 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.509 ' OG ' ' N ' ' A' ' 68' ' ' ARG . 27.1 t -174.71 -121.81 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.32 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.509 ' N ' ' OG ' ' A' ' 67' ' ' SER . 83.4 mtp180 55.34 -168.5 0.09 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.613 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.419 ' O ' ' O ' ' A' ' 68' ' ' ARG . 46.1 mt 59.24 149.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.291 179.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.512 ' C ' ' H ' ' A' ' 72' ' ' ILE . . . -53.57 170.1 0.96 Allowed Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.759 -0.936 . . . . 0.0 110.759 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.413 ' O ' ' HB3' ' A' ' 74' ' ' ALA . 83.9 mtp180 -72.26 30.53 0.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.664 0.269 . . . . 0.0 110.848 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.512 ' H ' ' C ' ' A' ' 70' ' ' GLY . 20.8 tt -65.91 -41.18 89.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.748 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.474 ' N ' HG23 ' A' ' 72' ' ' ILE . 17.1 pt-20 -77.76 -8.11 57.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.535 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.416 ' O ' ' O ' ' A' ' 75' ' ' ASP . . . -65.13 -36.88 85.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.426 179.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.416 ' O ' ' O ' ' A' ' 74' ' ' ALA . 70.3 m-20 -59.21 -149.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.361 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.9 t 57.06 71.92 0.54 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.833 0.349 . . . . 0.0 110.66 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -173.04 -75.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.48 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 70.2 m -59.93 -40.7 89.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.392 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.414 HE22 HD11 ' A' ' 83' ' ' ILE . 1.9 tm0? 72.08 -64.61 0.38 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.311 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -65.3 -47.0 78.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.574 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -65.88 -33.96 77.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.353 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.68 -43.37 98.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.857 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.414 HD11 HE22 ' A' ' 79' ' ' GLN . 94.2 mt -63.44 -43.84 98.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.201 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -63.62 -55.49 23.2 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -53.2 -46.25 68.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.3 mm -62.15 -45.58 98.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 179.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -50.88 -35.08 31.02 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.826 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.8 mmt-85 -66.15 -50.01 65.44 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.815 0.34 . . . . 0.0 110.091 179.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -69.44 -50.42 45.8 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.109 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.573 ' O ' HD23 ' A' ' 90' ' ' LEU . 1.3 tt -53.88 -41.68 67.82 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.004 0.431 . . . . 0.0 109.853 -178.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.95 -48.51 81.51 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.922 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -64.47 -51.94 60.51 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.412 -179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.418 HG12 ' HA ' ' A' ' 90' ' ' LEU . 3.1 p -68.62 -31.84 52.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.006 0.431 . . . . 0.0 109.894 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -60.23 -34.25 83.64 Favored Glycine 0 CA--C 1.519 0.292 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.41 -47.56 84.97 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.129 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 56.3 m -114.01 111.78 22.21 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.132 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 79.7 mtp -85.38 -102.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.505 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 43.9 t0 50.99 18.99 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.601 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 -140.58 -53.46 0.5 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.2 p -87.63 0.33 55.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.25 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.1 pt -39.72 148.56 0.3 Allowed Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.781 -179.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -37.16 155.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.49 1.269 0 C-N-CA 122.297 1.998 . . . . 0.0 112.358 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -69.55 -161.6 0.08 OUTLIER 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 122.923 2.416 . . . . 0.0 111.659 178.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.602 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . 76.78 -169.29 54.95 Favored Glycine 0 CA--C 1.518 0.269 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.708 HD12 ' N ' ' A' ' 105' ' ' LEU . 6.4 mp 55.19 -0.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.751 0.31 . . . . 0.0 110.735 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 107' ' ' ASN . 33.7 m -59.3 -50.4 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.913 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.605 ' N ' HG23 ' A' ' 106' ' ' VAL . 20.6 t-20 -57.36 -46.65 83.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.228 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -65.5 -42.57 95.67 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.083 -1.207 . . . . 0.0 110.083 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.4 tp -59.42 -40.84 88.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.78 -37.44 87.62 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.85 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.6 tp -61.74 -48.75 79.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.866 0.365 . . . . 0.0 111.27 -179.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.555 ' O ' ' N ' ' A' ' 116' ' ' THR . 16.4 pt20 -71.92 -45.17 62.14 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.033 179.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.99 -25.79 65.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.3 -179.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -79.33 -49.2 12.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.54 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.51 ' C ' ' H ' ' A' ' 117' ' ' SER . 98.3 m-20 -89.35 -56.71 3.15 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.053 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.555 ' N ' ' O ' ' A' ' 112' ' ' GLN . 1.7 m -61.75 0.69 0.32 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.031 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.569 ' C ' ' H ' ' A' ' 119' ' ' SER . 4.7 p -48.06 177.13 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.218 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 71.77 -31.27 0.22 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.569 ' H ' ' C ' ' A' ' 117' ' ' SER . 43.1 m -54.68 -33.05 60.25 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.83 -178.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 119' ' ' SER . 72.1 tt0 -41.12 164.74 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.06 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 64.4 29.52 13.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.455 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.409 ' OD2' ' O ' ' A' ' 119' ' ' SER . 97.1 m-20 -127.09 3.23 6.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.341 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 66.8 mmt-85 -64.83 -45.87 84.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.656 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -67.12 -41.3 86.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.629 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.577 ' HG2' ' HB3' ' A' ' 128' ' ' ALA . 8.9 ttm180 -80.73 9.39 6.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.21 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -59.09 -49.26 78.57 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.03 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -71.31 -41.26 70.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.124 0.488 . . . . 0.0 111.175 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.577 ' HB3' ' HG2' ' A' ' 125' ' ' ARG . . . -62.77 -28.58 70.08 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.791 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 125' ' ' ARG . 96.6 m -59.67 -52.68 64.47 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.952 -0.699 . . . . 0.0 110.099 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.16 -47.34 74.33 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.817 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 30.5 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.379 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -53.6 -39.04 64.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.919 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -64.17 -36.55 84.41 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.562 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 134' ' ' LEU . 0.2 OUTLIER -61.64 -48.94 78.6 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.545 -178.757 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.472 HD22 ' N ' ' A' ' 135' ' ' LEU . 4.2 mm? -61.3 -29.76 70.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.435 -179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 58.6 tp60 -57.51 -37.63 73.32 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.279 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -106.87 64.02 0.64 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.406 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.418 ' OH ' ' SD ' ' A' ' 142' ' ' MET . 6.2 t80 -166.89 92.3 0.74 Allowed Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.339 179.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.13 145.25 54.68 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 122.343 2.029 . . . . 0.0 112.11 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 58.1 -169.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.363 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.433 ' O ' ' CB ' ' A' ' 142' ' ' MET . 66.4 t0 -114.27 -31.46 6.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.532 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . 0.433 ' CB ' ' O ' ' A' ' 141' ' ' ASP . 2.5 ttt 77.99 -34.17 0.18 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.559 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.423 ' H ' ' C ' ' A' ' 141' ' ' ASP . 81.3 tt0 -65.36 -35.43 80.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.599 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -63.37 -40.99 98.76 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.776 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.475 ' OE1' ' N ' ' A' ' 145' ' ' GLU . 57.9 mp0 -67.7 -52.45 37.59 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.794 -0.762 . . . . 0.0 109.51 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -53.15 -38.76 63.02 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.555 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 16.8 m -61.85 -43.31 99.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.511 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 50.6 mtt -62.66 -39.42 93.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.747 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.48 -41.55 98.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.437 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.6 t -61.69 -42.3 93.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.281 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.41 -44.99 92.76 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.203 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.08 -31.5 72.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.818 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.74 -39.96 69.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.43 179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 16.3 mt -60.87 -42.14 97.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.039 -179.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.505 ' O ' HD13 ' A' ' 155' ' ' LEU . 0.2 OUTLIER -62.35 -49.79 74.15 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.978 -0.689 . . . . 0.0 109.667 -179.657 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -65.8 -36.04 82.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.621 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -62.27 -45.66 92.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.583 -179.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.13 -41.39 98.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.768 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.7 t -61.51 -46.65 96.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.485 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.41 -48.81 76.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.971 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 37.2 t -162.94 158.98 23.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.456 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -134.21 133.14 40.55 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.933 0.397 . . . . 0.0 110.429 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.12 155.0 80.75 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.322 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -66.51 -19.4 54.8 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.627 2.218 . . . . 0.0 111.867 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . 0.518 ' O ' ' N ' ' A' ' 167' ' ' LEU . 7.7 t 52.13 -148.07 0.42 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.256 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 45.3 mt 59.5 -74.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.755 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 165' ' ' SER . 47.5 mt -62.6 -41.07 98.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.313 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -62.55 -43.51 98.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.386 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . 0.442 ' O ' HG23 ' A' ' 173' ' ' THR . 98.8 m-20 -63.25 -44.14 96.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.651 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.444 ' O ' ' OG1' ' A' ' 173' ' ' THR . 71.0 t -63.41 -47.52 91.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.881 0.372 . . . . 0.0 110.398 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.07 -47.0 86.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.439 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -64.26 -40.34 95.8 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . 0.444 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 8.9 p -62.94 -43.76 97.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.607 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.7 m -61.97 -50.46 72.02 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.473 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.6 t -62.08 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.213 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -62.18 -39.74 93.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.709 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . 0.413 ' HA ' HE21 ' A' ' 180' ' ' GLN . 77.5 t80 -58.81 -47.08 86.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.583 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.6 mt -64.97 -42.82 95.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.004 0.431 . . . . 0.0 110.634 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.416 ' C ' ' N ' ' A' ' 181' ' ' ASN . 11.6 m120 -49.87 -34.49 20.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.696 -179.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.413 HE21 ' HA ' ' A' ' 177' ' ' PHE . 78.7 mt-30 -46.91 -19.48 0.1 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.91 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . 0.416 ' N ' ' C ' ' A' ' 179' ' ' ASN . 65.9 t30 -128.62 -46.4 1.3 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.094 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.407 ' O ' HG22 ' A' ' 186' ' ' VAL . 53.7 tp -62.99 -36.98 85.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.505 -179.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -51.45 -34.96 37.57 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.572 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -66.03 -50.59 63.69 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -61.83 -47.97 82.69 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.022 0.439 . . . . 0.0 111.686 -178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.407 HG22 ' O ' ' A' ' 182' ' ' LEU . 23.0 m -66.59 -32.97 60.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.253 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -59.67 -48.99 79.48 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.506 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.6 t -61.41 -42.75 99.24 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.76 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 88.5 mt -63.57 -38.62 91.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.365 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -52.27 -29.57 23.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.522 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -71.83 133.27 45.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.851 0.358 . . . . 0.0 110.532 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 54.28 34.2 19.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.425 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . 0.433 ' O ' ' O ' ' A' ' 194' ' ' MET . . . -83.14 -173.52 49.73 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . 0.433 ' O ' ' O ' ' A' ' 193' ' ' GLY . 81.4 mmm 56.17 158.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.908 0.385 . . . . 0.0 110.42 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 . . . . . 0 C--O 1.219 -0.552 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.459 -179.797 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 52.2 p30 -83.53 -2.69 56.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.876 0.37 . . . . 0.0 110.524 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -64.1 -39.78 94.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.524 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.0 t -102.37 123.65 46.54 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.393 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.9 t -159.03 158.8 33.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.463 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 32.1 p-80 -149.25 148.8 30.0 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.544 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 85.1 p -74.63 160.07 31.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.331 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 23.9 mmt85 -92.17 129.96 38.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.048 0.451 . . . . 0.0 110.645 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.579 HD22 ' N ' ' A' ' 69' ' ' LEU . 3.7 mm? -81.57 148.39 29.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.433 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -38.89 -88.32 0.01 OUTLIER Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.8 ttt-85 -155.81 97.83 1.86 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.866 0.365 . . . . 0.0 110.394 179.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.591 ' C ' ' H ' ' A' ' 74' ' ' ALA . 19.8 pt -137.23 171.74 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.336 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.162 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 61.05 -7.78 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.82 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.591 ' H ' ' C ' ' A' ' 72' ' ' ILE . . . -66.63 -35.48 80.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.555 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 32.6 p30 -92.1 13.87 17.64 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.572 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 94.7 p -55.67 -24.52 34.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.635 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.442 ' OE1' ' O ' ' A' ' 74' ' ' ALA . 57.7 mp0 -61.52 -36.22 79.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.28 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.3 m -122.78 113.36 19.08 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.067 0.461 . . . . 0.0 110.185 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -65.33 -34.16 77.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.67 -33.74 76.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.587 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -61.91 -35.6 78.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.068 -179.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.406 ' O ' HG22 ' A' ' 86' ' ' ILE . 95.6 mt -62.48 -45.42 98.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.216 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.533 ' O ' ' HB2' ' A' ' 87' ' ' ALA . 97.2 mt -65.99 -41.55 89.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.241 0.543 . . . . 0.0 110.388 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -69.12 -44.62 72.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.435 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -61.12 -56.18 23.88 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.035 -178.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.473 HG23 ' N ' ' A' ' 87' ' ' ALA . 18.8 tt -61.47 -41.19 89.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.441 0.639 . . . . 0.0 109.756 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 83' ' ' ILE . . . -51.02 -40.21 57.67 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.595 -179.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -68.58 -44.38 74.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.34 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -62.83 -50.34 71.34 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.8 mt -52.13 -39.82 60.45 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.126 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.96 -49.04 79.07 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.857 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -67.74 -50.77 55.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.284 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.473 HG22 HH21 ' A' ' 99' ' ' ARG . 87.3 t -60.23 -42.32 90.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.193 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -53.96 -43.42 71.8 Favored Glycine 0 CA--C 1.519 0.335 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -76.2 -47.16 25.08 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.542 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 98' ' ' ASP . 18.3 m -61.16 -71.8 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.532 -179.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 73.7 mmm 66.07 -41.65 0.36 Allowed 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.693 0.621 . . . . 0.0 110.656 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.52 ' H ' ' C ' ' A' ' 96' ' ' SER . 68.2 t0 -61.88 -40.07 94.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.489 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.473 HH21 HG22 ' A' ' 93' ' ' VAL . 71.8 ttp85 -64.66 -43.36 93.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.401 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.453 ' O ' ' C ' ' A' ' 101' ' ' ILE . 51.5 m -80.39 -127.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.381 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.453 ' C ' ' O ' ' A' ' 100' ' ' SER . 1.0 OUTLIER -28.65 93.46 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.467 0 O-C-N 123.616 0.573 . . . . 0.0 111.005 -179.872 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.433 ' N ' ' O ' ' A' ' 100' ' ' SER . 52.4 Cg_exo -48.99 166.66 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.546 0 C-N-CA 122.244 1.962 . . . . 0.0 112.399 -178.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.468 ' C ' ' H ' ' A' ' 105' ' ' LEU . 51.8 Cg_exo -53.74 146.59 44.18 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.335 2.023 . . . . 0.0 111.866 178.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.558 ' C ' ' H ' ' A' ' 106' ' ' VAL . . . -69.19 43.65 0.41 Allowed Glycine 0 CA--C 1.521 0.461 0 N-CA-C 110.801 -0.92 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.56 HD22 ' N ' ' A' ' 105' ' ' LEU . 3.7 mm? 58.55 -2.18 0.09 Allowed 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.558 ' H ' ' C ' ' A' ' 104' ' ' GLY . 13.8 p -70.77 -35.06 58.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.563 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -61.12 -40.84 95.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.509 -179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -62.13 -51.18 58.56 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.344 -1.102 . . . . 0.0 110.344 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 60.4 tp -62.86 -42.6 99.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.543 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.4 -48.48 81.58 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 40.0 tp -64.82 -45.06 87.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.742 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 -67.77 -26.9 66.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.667 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.432 ' O ' ' OG1' ' A' ' 116' ' ' THR . 57.1 tp -61.51 -43.0 99.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.135 -179.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -59.79 -34.11 72.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.836 0.351 . . . . 0.0 110.369 -179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -58.74 -40.37 83.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.224 -179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 113' ' ' LEU . 45.5 p -72.58 -20.7 61.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.489 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 52.4 p -89.78 7.55 36.34 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.474 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -59.87 -42.39 93.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.475 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.5 m -62.0 146.4 50.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.519 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 52.72 76.99 0.17 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.416 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.564 ' C ' ' H ' ' A' ' 123' ' ' ARG . 97.4 mt-10 -78.68 -174.49 3.93 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.375 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.401 ' OD1' ' OD2' ' A' ' 126' ' ' ASP . 36.1 t70 56.8 -0.0 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.529 -179.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.564 ' H ' ' C ' ' A' ' 121' ' ' GLU . 79.8 ttt180 -63.33 -44.47 94.81 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.526 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.548 ' O ' ' N ' ' A' ' 126' ' ' ASP . 11.0 m120 -126.49 -72.47 0.65 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -52.73 84.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.239 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.548 ' N ' ' O ' ' A' ' 124' ' ' ASN . 26.1 t0 -163.84 -93.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.046 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 31.8 mt -52.8 -38.24 60.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.535 -179.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.12 -47.84 71.4 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.338 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 81.8 m -62.36 -43.75 98.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.861 0.362 . . . . 0.0 110.455 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.96 -47.5 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.537 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -61.57 -42.43 98.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.404 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -64.03 -52.71 58.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.058 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -61.33 -44.62 96.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.683 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.31 -51.12 65.05 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.4 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' A' ' 135' ' ' LEU . 41.4 tp -57.72 -38.89 76.07 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.302 -178.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -56.69 -26.38 56.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.591 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -114.81 -130.64 0.31 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.004 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.572 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 46.5 t80 56.02 54.21 8.57 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 121.049 0.452 . . . . 0.0 110.677 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.437 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 57.0 Cg_endo -72.35 -13.75 28.05 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.557 2.172 . . . . 0.0 111.809 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 84.9 mtt85 -65.95 157.25 31.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.61 -179.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 56.12 29.22 14.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.614 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 50.1 mtt -149.77 -104.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.642 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -67.25 -32.66 73.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.598 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 12.2 tptm -58.38 -43.34 88.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.667 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -66.49 -51.87 52.11 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.545 ' O ' HG23 ' A' ' 150' ' ' VAL . 97.7 mttt -52.69 -40.9 63.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.313 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 98.5 m -59.83 -51.49 69.5 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.691 -0.403 . . . . 0.0 110.758 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 78.0 mtm -68.66 -40.0 80.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.017 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 62.9 mt -63.61 -43.18 97.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.691 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 146' ' ' LYS . 40.9 t -60.78 -44.73 98.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.217 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 54.4 tp -61.02 -46.74 89.51 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.205 -0.598 . . . . 0.0 110.51 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.43 -35.91 81.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.572 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 40.5 tp -70.28 -35.68 73.9 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.929 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.566 ' O ' HD13 ' A' ' 154' ' ' LEU . 0.2 OUTLIER -61.18 -45.96 92.47 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.449 -0.5 . . . . 0.0 109.868 -178.871 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.32 -46.06 91.84 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.313 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.2 -45.18 74.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.535 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -64.25 -36.54 84.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.339 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.29 -47.17 86.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.276 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 96.0 t -64.93 -45.26 95.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.708 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -57.36 -48.55 78.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.26 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . 0.506 ' C ' ' CG ' ' A' ' 162' ' ' HIS . 97.9 p -110.13 -133.11 0.33 Allowed 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.559 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.506 ' CG ' ' C ' ' A' ' 161' ' ' SER . 0.1 OUTLIER -179.99 165.78 1.23 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.974 0.416 . . . . 0.0 109.953 -179.822 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 4.6 p -73.02 149.76 89.9 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.65 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.68 -88.27 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.528 2.152 . . . . 0.0 112.307 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . 0.49 ' O ' ' NE ' ' A' ' 168' ' ' ARG . 15.7 t -170.77 -121.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.607 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 36.7 mt -80.97 -6.66 59.01 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.497 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 50.4 mt -62.23 -33.33 74.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.372 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.497 ' CG ' ' N ' ' A' ' 169' ' ' ASP . 14.8 ptp180 -60.95 -45.61 94.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.519 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . 0.497 ' N ' ' CG ' ' A' ' 168' ' ' ARG . 67.1 t0 -65.26 -40.76 94.38 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.68 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.9 t -61.37 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.305 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -57.09 -47.29 81.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.46 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . 0.692 ' CD2' HD21 ' A' ' 176' ' ' ASN . 73.5 t60 -61.55 -37.02 82.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.22 0.533 . . . . 0.0 110.142 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 79.4 m -65.78 -43.23 89.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.764 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 96.3 m -58.44 -52.36 65.95 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.939 -178.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 5.4 p -60.66 -38.17 77.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.06 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . 0.692 HD21 ' CD2' ' A' ' 172' ' ' HIS . 92.5 m-20 -61.89 -41.07 97.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.543 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -60.09 -46.55 89.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.399 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.545 HG22 HD22 ' A' ' 182' ' ' LEU . 53.2 mt -65.26 -43.24 95.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.01 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -51.11 -34.75 32.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.738 -179.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.53 ' NE2' ' O ' ' A' ' 176' ' ' ASN . 0.6 OUTLIER -67.46 -15.24 63.56 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.638 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . 0.423 ' OD1' ' O ' ' A' ' 180' ' ' GLN . 99.7 m-20 -142.86 35.89 1.41 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.67 0.271 . . . . 0.0 110.372 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.575 HD13 ' O ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER -60.95 -44.37 97.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.077 0.465 . . . . 0.0 110.502 -178.786 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -57.18 -46.71 82.58 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.21 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 15.3 m -57.23 -43.3 82.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.328 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . 0.487 ' CD2' HG23 ' A' ' 178' ' ' ILE . 32.4 m-85 -66.05 -34.18 77.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.007 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 182' ' ' LEU . 43.7 t -59.91 -48.55 87.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.559 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -62.28 -52.73 62.55 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.147 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 96.5 p -57.99 -22.05 47.62 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.767 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.566 HD13 ' O ' ' A' ' 189' ' ' LEU . 0.2 OUTLIER -61.03 -46.8 89.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.352 -179.44 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -96.17 146.53 24.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.521 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -64.38 -36.58 84.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.46 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -89.41 105.25 17.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.607 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -66.06 -41.46 95.1 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 12.2 ttt -146.1 151.15 37.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.832 0.349 . . . . 0.0 110.571 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.521 179.818 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.418 -1.473 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -76.4 143.92 40.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.881 0.372 . . . . 0.0 110.812 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -94.8 128.12 41.3 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.406 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.499 ' O ' ' N ' ' A' ' 66' ' ' HIS . 34.9 t -152.88 137.14 16.56 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.822 0.344 . . . . 0.0 110.855 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.7 p 45.34 15.96 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.295 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.499 ' N ' ' O ' ' A' ' 64' ' ' SER . 29.9 m170 -87.97 -14.98 37.75 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.522 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 78.2 p -61.88 -34.99 77.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.41 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 78.0 ttt-85 -102.22 100.78 11.01 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.031 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 67.7 mt 41.06 65.17 0.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.478 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.08 -67.62 1.93 Allowed Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.0 ttp85 -94.24 101.33 13.3 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.559 ' O ' ' N ' ' A' ' 74' ' ' ALA . 96.3 mt -93.66 111.03 24.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 53.09 -81.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.559 ' N ' ' O ' ' A' ' 72' ' ' ILE . . . -178.56 -3.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.411 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.425 ' H ' ' H ' ' A' ' 74' ' ' ALA . 90.1 m-20 -84.75 1.59 45.92 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.97 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 90.7 p -58.75 -42.85 89.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.802 0.334 . . . . 0.0 110.54 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -71.98 -35.04 69.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.642 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.0 m -85.64 20.52 2.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.361 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -52.3 -29.63 24.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.588 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.26 -38.98 91.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.44 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -63.06 -43.54 98.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.811 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 87.9 mt -63.02 -43.16 98.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.615 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.1 mt -61.34 -42.4 93.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -54.01 -54.69 35.6 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -54.79 -40.17 69.19 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.687 0.279 . . . . 0.0 110.427 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.41 HD13 ' HA ' ' A' ' 86' ' ' ILE . 29.0 mm -64.49 -46.36 92.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.323 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.43 -38.7 90.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.649 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -59.4 -48.96 79.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.823 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 43.0 m-70 -66.79 -40.54 88.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.089 0.471 . . . . 0.0 110.118 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.542 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.2 tt -67.24 -37.43 83.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.511 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.59 -47.8 83.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.75 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -64.74 -52.17 58.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.554 -0.459 . . . . 0.0 110.153 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.88 -26.74 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.578 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -76.14 -31.28 55.61 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -61.76 -46.98 87.24 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.496 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.1 p -66.48 -32.05 73.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.554 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 60.8 ttp -61.35 -36.18 79.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.388 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -62.54 -17.22 59.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.939 0.4 . . . . 0.0 110.314 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -59.38 -44.92 92.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.072 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t -123.02 115.18 21.45 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.139 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.655 ' O ' HG23 ' A' ' 101' ' ' ILE . 16.5 tt -171.13 79.52 0.53 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.623 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.488 ' O ' ' N ' ' A' ' 104' ' ' GLY . 23.3 Cg_exo -62.82 156.35 54.27 Favored 'Trans proline' 0 C--N 1.302 -1.904 0 C-N-CA 122.532 2.155 . . . . 0.0 112.197 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.535 ' O ' ' N ' ' A' ' 105' ' ' LEU . 37.0 Cg_exo -42.45 -18.31 0.09 OUTLIER 'Trans proline' 0 C--N 1.311 -1.447 0 C-N-CA 122.752 2.301 . . . . 0.0 111.738 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.488 ' N ' ' O ' ' A' ' 102' ' ' PRO . . . 59.55 -75.67 0.01 OUTLIER Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.042 -0.823 . . . . 0.0 111.042 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.684 ' N ' HD23 ' A' ' 105' ' ' LEU . 1.8 pt? -179.24 -25.19 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.905 0.383 . . . . 0.0 110.825 -178.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 66.2 t -58.93 -46.13 91.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.403 -179.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -59.87 -45.05 93.72 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.087 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -77.15 -22.66 70.54 Favored Glycine 0 CA--C 1.522 0.523 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.457 ' N ' ' O ' ' A' ' 105' ' ' LEU . 53.4 tp -61.85 -48.59 79.88 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.325 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.04 -48.07 77.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.322 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.5 tp -64.76 -43.36 93.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.428 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.04 -44.86 75.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.258 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 tp -63.51 -44.64 93.7 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.388 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -51.37 -38.28 52.5 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.86 -51.55 54.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.046 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 21.0 m -66.83 -47.29 72.47 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.311 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.1 m -54.44 98.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.473 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.8 mtp85 -137.45 -121.53 0.14 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.291 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 46.5 m -59.62 -38.68 81.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.422 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -65.32 -166.86 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.829 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 57.57 41.67 25.35 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.441 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -152.18 -9.87 0.19 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.536 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -82.45 -80.21 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.256 -179.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 34.9 t30 -64.2 -41.48 97.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.072 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.49 54.69 0.76 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.043 0.449 . . . . 0.0 110.313 -179.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -130.97 -75.07 0.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.427 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.2 mt -64.0 -33.5 75.87 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.55 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.33 -44.15 71.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.087 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 20.8 m -60.33 -51.41 69.64 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.654 -0.419 . . . . 0.0 110.19 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.27 -46.39 80.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.159 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 36.7 tp -61.58 -43.35 99.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.567 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -62.41 -51.56 67.05 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.387 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mm-40 -60.87 -39.86 90.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.141 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 38.2 tp -61.55 -51.39 68.76 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.781 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.574 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -59.64 -38.13 80.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.299 0.571 . . . . 0.0 110.44 -177.808 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -56.43 -25.6 50.85 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.312 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -156.07 98.05 1.85 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.566 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.575 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 6.7 p90 -141.43 68.49 26.06 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-O 121.526 0.679 . . . . 0.0 110.352 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_exo -51.9 -37.61 67.02 Favored 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 122.462 2.108 . . . . 0.0 112.439 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.432 ' O ' ' OD1' ' A' ' 141' ' ' ASP . 74.9 mtp180 42.62 -112.28 0.2 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.62 -179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 140' ' ' ARG . 97.7 m-20 -141.93 106.3 4.82 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.542 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 10.7 ptm -154.84 -34.94 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.604 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.8 tp10 -64.41 -37.89 89.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 0.0 110.141 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 67.4 mmtt -64.15 -46.01 85.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.033 0.444 . . . . 0.0 110.066 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -55.28 -30.16 59.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.64 -178.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 150' ' ' VAL . 97.4 mttt -69.13 -43.73 73.78 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.214 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.429 ' O ' ' CB ' ' A' ' 151' ' ' LEU . 84.2 m -69.96 -36.02 74.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.537 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 59.4 mtt -60.27 -46.03 91.23 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.02 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 9.3 mp -73.25 -50.6 21.43 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.43 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 146' ' ' LYS . 79.1 t -60.56 -45.74 96.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.498 -178.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.429 ' CB ' ' O ' ' A' ' 147' ' ' THR . 56.6 tp -58.05 -44.72 87.58 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.496 -179.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -61.87 -36.7 82.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.344 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.516 ' CG ' ' HZ3' ' A' ' 157' ' ' LYS . 38.5 tp -63.67 -42.05 98.11 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 121.02 -0.272 . . . . 0.0 110.912 -179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.34 -42.42 95.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.414 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.22 -40.24 96.9 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.75 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -72.16 -39.02 69.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.269 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.516 ' HZ3' ' CG ' ' A' ' 153' ' ' LEU . 31.2 mttp -62.73 -44.68 95.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.834 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -61.7 -44.21 97.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.457 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 80.7 t -65.48 -43.06 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.085 179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -60.15 -47.63 85.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.81 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 74.5 m -167.89 168.12 12.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.39 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -117.92 127.04 53.47 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.989 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.46 156.91 59.16 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.643 -179.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -69.67 157.59 60.04 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 122.954 2.436 . . . . 0.0 112.537 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 54.8 m -83.18 -33.39 26.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.056 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 73.2 mt -60.64 -53.46 57.24 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 110.754 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 167' ' ' LEU . 0.2 OUTLIER -62.19 -41.79 98.67 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.89 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -59.08 -43.32 91.77 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.221 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -61.98 -43.28 99.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.677 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.452 ' O ' ' OG1' ' A' ' 173' ' ' THR . 96.4 t -62.88 -43.34 98.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.066 0.46 . . . . 0.0 110.221 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -56.29 -49.24 74.82 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -61.86 -45.35 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.544 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 19.4 p -58.37 -45.69 87.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.195 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -54.04 -45.71 71.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 110.272 -179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 86.0 t -61.13 -44.42 98.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.782 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -60.93 -39.56 89.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.499 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -59.46 -42.46 92.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.492 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 96.6 mt -61.99 -41.45 91.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.683 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -59.35 -34.54 72.5 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.6 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -65.8 -48.44 71.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.979 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -106.68 48.56 0.83 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 120.95 0.405 . . . . 0.0 110.371 -179.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 55.0 tp -63.95 -41.19 97.66 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.824 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -60.11 -45.59 92.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.245 0.545 . . . . 0.0 110.021 -179.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.0 m -57.18 -44.62 83.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.809 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -58.17 -39.7 79.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.58 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.5 t -58.43 -50.2 79.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.035 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -68.47 -45.84 71.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.299 0.571 . . . . 0.0 110.745 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 23.6 p -58.64 -35.07 71.93 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.998 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.611 ' O ' ' HB3' ' A' ' 190' ' ' ALA . 85.3 mt -99.37 30.06 3.7 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.266 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . 0.611 ' HB3' ' O ' ' A' ' 189' ' ' LEU . . . 80.23 116.04 0.06 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.037 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 8.8 tmm_? -76.11 135.05 39.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.874 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.42 ' OD1' ' O ' ' A' ' 192' ' ' ASN . 46.1 p-10 -103.55 134.94 46.07 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.761 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -158.74 26.78 0.4 Allowed Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 95.9 mtp 45.59 41.7 7.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.812 0.339 . . . . 0.0 110.574 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 54.8 p-10 . . . . . 0 C--O 1.221 -0.429 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.695 179.994 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -140.63 115.46 9.65 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.814 0.34 . . . . 0.0 110.526 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.1 ptt-85 -148.27 171.25 16.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.56 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.466 ' OG ' ' N ' ' A' ' 65' ' ' SER . 87.9 p 48.86 -96.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.803 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.466 ' N ' ' OG ' ' A' ' 64' ' ' SER . 24.3 p 58.41 95.71 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.532 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -75.84 137.14 40.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.323 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.7 t -164.49 40.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.894 0.378 . . . . 0.0 110.597 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -63.64 -38.14 89.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.781 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.57 ' H ' HD23 ' A' ' 69' ' ' LEU . 0.1 OUTLIER -74.22 146.82 43.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.021 -179.632 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' A' ' 69' ' ' LEU . . . -60.56 -140.99 0.01 OUTLIER Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.432 ' O ' ' O ' ' A' ' 72' ' ' ILE . 94.0 mtm-85 -92.4 9.47 34.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.771 0.32 . . . . 0.0 110.283 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.677 ' C ' ' H ' ' A' ' 74' ' ' ALA . 4.0 mm -60.59 -140.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.915 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.579 ' H ' HG22 ' A' ' 72' ' ' ILE . 81.2 tt0 62.35 -24.26 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.827 -179.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.677 ' H ' ' C ' ' A' ' 72' ' ' ILE . . . -60.27 -156.88 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 110.32 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 92.3 m-20 49.79 20.34 0.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.452 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.2 p -61.48 -24.63 66.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.393 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -62.63 -39.35 93.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.538 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.1 m -109.75 94.91 5.27 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.916 0.389 . . . . 0.0 110.498 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -60.66 -31.52 70.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.952 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -66.89 -36.61 82.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.449 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -61.52 -45.27 94.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.158 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.453 ' O ' HG22 ' A' ' 86' ' ' ILE . 96.6 mt -65.08 -44.38 95.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.354 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.405 ' O ' ' HB2' ' A' ' 87' ' ' ALA . 97.2 mt -66.07 -41.11 88.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.253 0.549 . . . . 0.0 110.27 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -70.61 -50.31 38.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.851 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -52.91 -55.09 25.87 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.303 -178.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.535 HG23 ' N ' ' A' ' 87' ' ' ALA . 21.0 tt -63.29 -44.61 99.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.724 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.535 ' N ' HG23 ' A' ' 86' ' ' ILE . . . -51.13 -39.38 56.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.955 -178.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -65.26 -49.79 68.26 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.959 0.409 . . . . 0.0 110.411 178.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -66.94 -52.15 46.47 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 120.337 -0.545 . . . . 0.0 109.896 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.421 ' O ' ' N ' ' A' ' 94' ' ' GLY . 6.6 tt -52.84 -38.48 61.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.114 -179.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.11 -48.67 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.158 -0.617 . . . . 0.0 109.748 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -67.76 -46.01 73.3 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.854 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 96' ' ' SER . 69.3 t -66.23 -40.38 86.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.195 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -55.78 -42.91 86.7 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -61.69 -47.48 85.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.199 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 93' ' ' VAL . 46.7 t -109.07 110.8 22.15 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.075 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.435 ' O ' ' O ' ' A' ' 98' ' ' ASP . 10.8 ttm -64.95 -11.34 37.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.924 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.488 ' O ' ' N ' ' A' ' 100' ' ' SER . 98.8 m-20 -53.29 -167.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 51.5 -88.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.154 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 98' ' ' ASP . 48.1 t -77.56 82.74 3.98 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.685 ' O ' HG23 ' A' ' 101' ' ' ILE . 15.3 tt -119.82 83.9 30.46 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.521 ' N ' ' CD ' ' A' ' 103' ' ' PRO . 23.4 Cg_exo -53.73 -40.61 79.23 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 122.006 1.804 . . . . 0.0 111.71 178.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 102' ' ' PRO . 64.4 Cg_endo -81.39 -168.49 0.63 Allowed 'Trans proline' 0 N--CA 1.488 1.159 0 C-N-CA 122.121 1.881 . . . . 0.0 112.247 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.96 4.45 90.0 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 77.7 mt -63.28 -42.62 99.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.735 0.302 . . . . 0.0 110.978 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.6 p -69.49 -34.56 62.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.066 0.46 . . . . 0.0 110.467 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.33 -41.6 98.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.174 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -52.83 -42.24 59.42 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.599 HD23 ' O ' ' A' ' 109' ' ' LEU . 3.1 tt -60.75 -48.45 81.73 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.994 0.426 . . . . 0.0 110.041 -179.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.78 93.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.526 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.611 HD23 ' O ' ' A' ' 111' ' ' LEU . 2.9 tt -63.31 -47.56 81.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.943 0.401 . . . . 0.0 110.165 -179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -64.86 -39.71 93.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.307 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.23 -42.31 99.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.402 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -64.8 -38.08 89.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.17 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.13 -37.97 75.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.155 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 20.2 m -60.69 -44.68 96.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.497 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.0 t -96.32 79.27 3.11 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.975 0.417 . . . . 0.0 110.175 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -64.04 -39.95 95.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.644 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.9 m -54.7 -40.07 68.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.652 -179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -76.1 55.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.453 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -173.02 -53.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.471 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 122' ' ' ASP . 67.8 t0 -53.87 -31.93 51.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.19 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -54.51 -77.02 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.565 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.463 ' O ' ' N ' ' A' ' 126' ' ' ASP . 80.8 m-20 -63.3 -40.61 97.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.318 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -65.16 73.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.486 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.463 ' N ' ' O ' ' A' ' 124' ' ' ASN . 64.2 t0 -146.64 -90.5 0.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.148 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 60.2 mt -52.01 -33.13 37.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.672 0.272 . . . . 0.0 110.577 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.41 -49.62 69.52 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.817 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 15.5 m -62.95 -42.72 99.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.334 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.46 -46.92 80.13 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 83.0 mt -58.93 -41.26 86.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.1 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -54.94 -52.43 63.02 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.707 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -51.98 -47.91 64.65 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.107 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.556 ' O ' HD13 ' A' ' 134' ' ' LEU . 0.2 OUTLIER -64.1 -42.89 96.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.512 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -56.63 -47.69 79.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.036 -178.806 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -56.48 -29.78 62.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.214 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . 0.423 ' O ' ' O ' ' A' ' 134' ' ' LEU . . . -107.79 97.7 7.38 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.408 ' C ' ' O ' ' A' ' 137' ' ' ALA . 2.0 t80 -38.21 131.96 0.98 Allowed Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.998 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -44.94 -46.69 12.75 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.035 1.823 . . . . 0.0 112.246 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.415 ' O ' ' CB ' ' A' ' 141' ' ' ASP . 97.1 mtt180 -45.47 -91.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.681 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.519 ' C ' ' H ' ' A' ' 143' ' ' GLU . 2.0 t70 75.08 7.01 4.23 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.083 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.7 26.1 0.07 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.01 0.433 . . . . 0.0 110.041 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.519 ' H ' ' C ' ' A' ' 141' ' ' ASP . 82.2 tt0 -66.84 -40.96 88.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.479 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -60.84 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.199 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -72.59 -52.52 15.15 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.992 -0.683 . . . . 0.0 109.289 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -52.36 -39.7 61.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.236 -179.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 70.6 m -63.64 -44.17 94.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.617 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 18.9 mtm -62.89 -38.75 92.14 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.577 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.12 -41.79 99.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.076 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 75.8 t -63.39 -42.54 96.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.623 -179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.82 -45.26 90.38 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.195 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.41 -31.56 72.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.306 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 10.1 tp -71.98 -41.32 67.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.896 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.994 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 94.6 mt -63.46 -44.09 95.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.17 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.8 -40.67 79.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.016 0.436 . . . . 0.0 110.312 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 35.7 mmtm -64.2 -42.72 96.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.045 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -60.29 -45.12 94.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.308 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 70.5 t -62.29 -45.81 97.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.237 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -64.16 -41.43 97.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.767 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 28.8 t -142.97 145.14 32.69 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.366 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 35.8 m80 -68.64 -139.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.479 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 5.3 p -140.05 150.57 62.51 Favored Pre-proline 0 CA--C 1.535 0.368 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.081 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.445 ' O ' ' CB ' ' A' ' 165' ' ' SER . 44.2 Cg_exo -41.96 -64.58 0.24 Allowed 'Trans proline' 0 N--CA 1.49 1.3 0 C-N-CA 122.232 1.955 . . . . 0.0 112.565 179.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . 0.451 ' C ' ' H ' ' A' ' 167' ' ' LEU . 1.5 m 165.48 -167.82 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.311 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.533 HD12 ' N ' ' A' ' 166' ' ' LEU . 10.8 mp -67.05 4.13 0.96 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.407 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.451 ' H ' ' C ' ' A' ' 165' ' ' SER . 58.0 mt -61.36 -31.7 71.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.262 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -65.06 -42.48 94.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 0.0 110.626 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -64.87 -43.84 91.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.658 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 89.9 t -61.19 -45.65 98.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.097 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -57.29 -42.91 82.61 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.097 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -59.78 -40.57 88.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.605 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 20.1 m -59.84 -44.89 93.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.547 -179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.4 m -59.36 -45.93 90.04 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 110.639 -179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.09 -44.53 95.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.146 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -61.9 -38.84 89.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.541 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . 0.562 ' CE2' ' CD2' ' A' ' 182' ' ' LEU . 86.1 t80 -57.21 -47.94 80.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.354 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.599 ' O ' ' N ' ' A' ' 183' ' ' ARG . 63.2 mt -64.9 -42.3 94.46 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.327 0 CA-C-O 121.053 0.454 . . . . 0.0 110.04 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.539 ' O ' ' N ' ' A' ' 181' ' ' ASN . 60.3 t-20 -59.26 -34.07 71.81 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.789 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.604 ' C ' ' H ' ' A' ' 182' ' ' LEU . 48.2 tt0 -59.08 70.84 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.634 -179.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' A' ' 179' ' ' ASN . 6.3 m120 62.5 -20.35 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.604 ' H ' ' C ' ' A' ' 180' ' ' GLN . 9.3 mp -63.3 -37.3 86.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.804 0.335 . . . . 0.0 110.175 179.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . 0.599 ' N ' ' O ' ' A' ' 178' ' ' ILE . 41.5 ttm180 -57.36 -36.88 71.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.509 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.5 m -59.69 -51.03 71.51 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.733 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -66.83 -39.86 87.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.113 0.482 . . . . 0.0 110.691 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.24 -39.65 83.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.332 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -61.23 -44.62 96.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.644 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 72.3 m -58.49 -38.31 77.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.857 0.361 . . . . 0.0 110.391 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 57.3 tp -70.46 98.72 1.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.619 -0.433 . . . . 0.0 110.204 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 193' ' ' GLY . . . -172.66 -35.43 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.634 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -64.88 -42.09 95.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.762 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 44.4 t30 -61.9 -40.22 94.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.863 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . 0.424 ' O ' ' O ' ' A' ' 190' ' ' ALA . . . -151.99 158.44 27.79 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 8.7 ptp -149.14 160.02 43.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.869 0.366 . . . . 0.0 110.368 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 117.974 -1.012 . . . . 0.0 110.596 179.854 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.424 ' O ' ' OG ' ' A' ' 65' ' ' SER . 98.2 m-20 -62.25 -41.19 98.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.813 0.34 . . . . 0.0 110.634 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 80.5 mtp85 -78.55 147.57 33.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.5 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.5 m 52.4 27.24 4.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.682 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 62' ' ' ASN . 67.7 m -59.95 -39.31 85.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.46 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 62.0 m80 48.79 26.1 1.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.573 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 79.3 p -56.52 -32.16 64.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.286 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -78.47 140.93 38.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.284 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.589 HD12 ' N ' ' A' ' 69' ' ' LEU . 9.8 mp -76.51 142.94 40.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.526 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.29 38.1 0.82 Allowed Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.467 ' H ' ' C ' ' A' ' 69' ' ' LEU . 22.9 mmt85 51.96 63.18 2.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.971 0.415 . . . . 0.0 110.422 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.431 ' C ' ' H ' ' A' ' 74' ' ' ALA . 17.8 tt -66.11 -33.13 61.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.417 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.452 ' O ' ' O ' ' A' ' 74' ' ' ALA . 96.9 mt-10 -54.11 -10.21 0.33 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.493 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.555 ' O ' ' N ' ' A' ' 76' ' ' SER . . . -59.17 -129.48 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.546 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 54.74 -80.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.498 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.555 ' N ' ' O ' ' A' ' 74' ' ' ALA . 27.3 t -44.98 99.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.601 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 48.25 24.64 0.71 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.552 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 56.2 p 40.78 36.36 0.4 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.683 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -47.37 -29.94 2.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.555 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -67.2 -33.87 76.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.689 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -55.72 -46.79 77.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.522 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.672 HD12 ' N ' ' A' ' 82' ' ' ILE . 2.0 mp -62.79 -46.04 97.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.357 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 97.2 mt -62.11 -43.04 97.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.684 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.3 ttt85 -50.97 -49.96 59.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.643 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -56.46 -43.85 79.95 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.632 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.5 mp -60.89 -50.1 81.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.456 -0.497 . . . . 0.0 109.722 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.1 89.85 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -57.8 -48.5 79.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.67 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -66.75 -40.42 88.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.158 0.504 . . . . 0.0 110.245 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 94' ' ' GLY . 5.9 tt -66.91 -38.87 87.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.625 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.405 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -59.97 -42.02 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.628 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -65.41 -52.51 52.82 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.133 -0.627 . . . . 0.0 109.921 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.5 t -69.66 -26.08 29.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.815 179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -85.5 -37.36 9.71 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 111.224 -0.75 . . . . 0.0 111.224 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.455 ' O ' ' O ' ' A' ' 96' ' ' SER . 42.7 t0 -72.05 -46.46 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.614 0.245 . . . . 0.0 110.941 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.457 ' C ' ' H ' ' A' ' 98' ' ' ASP . 70.9 m -57.62 -123.22 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.917 0.389 . . . . 0.0 111.034 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 7.6 ttt 62.66 1.44 0.79 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.035 0.445 . . . . 0.0 110.251 -179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.457 ' H ' ' C ' ' A' ' 96' ' ' SER . 43.5 t0 -62.74 -37.59 87.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.512 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.3 mtp85 -66.98 135.48 53.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.537 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 t 44.4 89.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.472 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.754 ' O ' HG23 ' A' ' 101' ' ' ILE . 9.3 tp -159.69 66.17 2.71 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.168 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.517 ' N ' ' CD ' ' A' ' 103' ' ' PRO . 31.9 Cg_exo -49.1 -39.8 41.51 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 121.936 1.758 . . . . 0.0 111.998 178.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.517 ' CD ' ' N ' ' A' ' 102' ' ' PRO . 31.7 Cg_exo -59.18 -158.28 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 122.222 1.948 . . . . 0.0 112.183 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 88.71 -2.69 84.69 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.568 HD12 ' N ' ' A' ' 105' ' ' LEU . 9.9 mp -89.31 -11.53 43.15 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.909 0.385 . . . . 0.0 110.296 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 14.5 p -62.36 -32.75 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.735 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.423 ' O ' ' OD1' ' A' ' 107' ' ' ASN . 56.5 t-20 -60.32 -30.19 69.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.14 0.495 . . . . 0.0 110.518 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -64.42 -47.72 81.38 Favored Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 179.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.631 ' N ' HD22 ' A' ' 109' ' ' LEU . 3.5 mm? -62.91 -38.52 91.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.719 0.295 . . . . 0.0 110.708 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.99 73.31 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.236 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.608 HD23 ' O ' ' A' ' 111' ' ' LEU . 2.6 tt -70.63 -48.09 56.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -61.79 -25.49 67.51 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.689 -179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.41 ' N ' ' O ' ' A' ' 109' ' ' LEU . 58.6 tp -60.22 -43.11 96.27 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.151 -0.62 . . . . 0.0 110.17 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.59 -42.64 98.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.576 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -65.46 -43.37 90.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.686 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.9 m -64.23 -46.98 81.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.66 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 3.7 m -88.67 57.12 4.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.488 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -61.25 -38.71 87.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.485 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.1 m -80.92 -96.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.429 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 40.65 77.65 0.05 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.592 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -167.52 -178.27 3.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.636 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 55.96 33.94 22.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.644 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -136.38 -40.54 0.65 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.557 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -153.41 12.17 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.696 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -105.63 -34.78 7.63 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.433 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -45.65 -85.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.688 -179.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.3 pp -50.76 -32.22 19.13 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 121.155 -0.218 . . . . 0.0 110.983 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.76 -48.24 69.91 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.972 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 8.4 m -60.2 -38.6 83.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.085 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.23 -47.55 78.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.018 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.15 -44.43 94.97 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.479 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -62.86 -51.03 68.6 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.891 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -54.82 -37.88 66.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.598 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 54.8 tp -60.04 -51.14 70.92 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.405 -0.518 . . . . 0.0 110.28 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.11 -44.22 97.68 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.3 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 98.7 mm-40 -58.46 -37.63 75.85 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 138' ' ' TYR . . . -66.73 -76.35 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.321 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.43 ' C ' ' O ' ' A' ' 137' ' ' ALA . 55.9 t80 -32.7 99.5 0.15 Allowed Pre-proline 0 CA--C 1.54 0.565 0 O-C-N 123.147 0.279 . . . . 0.0 111.054 -179.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -79.75 168.44 19.4 Favored 'Trans proline' 0 C--N 1.313 -1.291 0 C-N-CA 122.127 1.885 . . . . 0.0 111.975 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.553 ' H ' ' HD3' ' A' ' 140' ' ' ARG . 1.0 OUTLIER -82.49 35.02 0.44 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.309 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -81.37 90.41 6.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 65.3 mtt -98.67 16.14 22.98 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.412 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.9 tp10 -59.99 -42.52 94.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.415 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -61.31 -33.54 73.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.654 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -70.2 -44.2 69.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.375 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.4 ' O ' HG23 ' A' ' 150' ' ' VAL . 53.7 mtmt -66.5 -39.46 88.71 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.736 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 72.5 m -59.7 -43.3 94.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.444 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 49.2 mtt -61.15 -45.97 92.45 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.152 -179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 10.7 mp -71.33 -50.36 33.16 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.516 178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 146' ' ' LYS . 71.0 t -58.73 -43.41 87.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.095 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 42.0 tp -59.37 -45.92 90.11 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.134 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -57.41 -42.48 82.39 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.916 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 60.0 tp -57.61 -39.93 77.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.452 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.41 -41.72 90.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.61 -44.61 95.87 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.017 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -68.25 -35.78 78.44 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.998 0.428 . . . . 0.0 110.262 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 161' ' ' SER . 0.9 OUTLIER -60.27 -45.71 92.36 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.02 -0.537 . . . . 0.0 109.858 -179.244 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -62.55 -37.71 87.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.588 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 97.2 t -69.11 -51.72 40.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.521 178.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.692 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -72.53 -50.54 25.01 Favored 'General case' 0 C--O 1.218 -0.578 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.184 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . 0.502 ' N ' ' O ' ' A' ' 157' ' ' LYS . 78.2 p 24.18 35.02 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.171 0.51 . . . . 0.0 111.165 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.692 ' N ' ' O ' ' A' ' 160' ' ' ALA . 5.7 p80 -155.98 137.99 14.52 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.389 -178.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 3.1 m -162.62 128.22 2.22 Favored Pre-proline 0 CA--C 1.538 0.512 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.22 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_exo -44.16 -31.38 4.08 Favored 'Trans proline' 0 N--CA 1.49 1.306 0 C-N-CA 121.85 1.7 . . . . 0.0 112.409 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . 0.482 ' O ' ' N ' ' A' ' 167' ' ' LEU . 1.1 m 73.66 -158.56 0.08 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 38.7 mt 65.29 -59.28 0.27 Allowed 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.654 0.596 . . . . 0.0 110.389 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.482 ' N ' ' O ' ' A' ' 165' ' ' SER . 85.5 mt -63.96 -31.71 72.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.234 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.43 -42.04 79.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.046 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -60.7 -47.09 87.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.081 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.422 HG23 ' N ' ' A' ' 171' ' ' PHE . 27.8 m -70.71 -40.04 76.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.657 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . 0.45 ' O ' HG23 ' A' ' 175' ' ' VAL . 86.3 t80 -58.53 -45.41 88.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.52 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.86 -47.13 79.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.665 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.88 -39.9 91.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.611 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 71.2 m -60.41 -44.6 95.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.876 0.369 . . . . 0.0 110.443 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 171' ' ' PHE . 73.0 t -63.72 -40.6 89.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.549 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -64.69 -42.34 95.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.269 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 93.8 t80 -63.75 -52.34 60.86 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.826 0.346 . . . . 0.0 111.653 -179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 20.3 tt -68.8 -35.3 68.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.547 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.415 ' O ' ' CB ' ' A' ' 183' ' ' ARG . 0.8 OUTLIER -49.71 -34.46 18.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.575 -179.699 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.404 ' C ' ' O ' ' A' ' 179' ' ' ASN . 88.1 mt-30 -37.86 -43.01 0.65 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.671 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -104.62 -44.85 4.78 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.811 0.339 . . . . 0.0 111.272 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' ' 182' ' ' LEU . 4.1 mm? -60.97 -36.57 79.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.551 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . 0.415 ' CB ' ' O ' ' A' ' 179' ' ' ASN . 64.0 ttm-85 -51.89 -42.29 62.59 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.726 -179.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 19.4 m -61.44 -52.3 65.13 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.689 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.64 -40.81 76.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.83 0.348 . . . . 0.0 110.808 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.72 -43.77 96.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.316 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 72.0 ttp85 -59.72 -53.04 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.613 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 21.4 m -63.22 -40.43 97.46 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 49.9 tp -42.02 -70.57 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.561 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -175.32 25.57 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.636 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 19.8 tpt85 -115.24 132.45 56.61 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.954 0.407 . . . . 0.0 110.429 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 55.43 41.47 30.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.404 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . 0.526 ' O ' ' N ' ' A' ' 195' ' ' ASP . . . -63.31 161.62 34.02 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 87.1 mmm 45.11 -89.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.693 0.283 . . . . 0.0 110.515 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 193' ' ' GLY . 53.3 t0 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.477 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.336 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 55.45 43.89 27.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.938 0.399 . . . . 0.0 110.502 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.0 tpp180 -58.46 -44.02 89.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.769 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.7 p 62.17 20.76 11.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.821 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 52.4 p -67.16 -33.49 75.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.715 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -91.46 93.95 9.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.427 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.9 t -85.99 -82.29 0.2 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.584 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -107.46 143.71 35.43 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.653 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.568 HD22 ' N ' ' A' ' 69' ' ' LEU . 3.8 mm? -88.72 1.65 54.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.484 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 90.75 -154.32 23.1 Favored Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -67.52 134.13 50.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.111 0.482 . . . . 0.0 110.355 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.454 HG13 ' H ' ' A' ' 75' ' ' ASP . 37.2 pt -152.74 -138.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.482 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -73.36 50.41 0.3 Allowed 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.313 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.502 ' O ' ' N ' ' A' ' 76' ' ' SER . . . 61.85 22.01 12.69 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.895 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.454 ' H ' HG13 ' A' ' 72' ' ' ILE . 29.1 t0 41.11 22.97 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 120.92 0.39 . . . . 0.0 110.424 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.543 ' C ' ' H ' ' A' ' 78' ' ' SER . 7.1 t 40.64 38.96 0.68 Allowed 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.523 -179.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.498 ' O ' ' CB ' ' A' ' 78' ' ' SER . 75.3 tt0 69.32 -37.03 0.36 Allowed 'General case' 0 C--N 1.332 -0.171 0 O-C-N 123.919 0.762 . . . . 0.0 110.288 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.543 ' H ' ' C ' ' A' ' 76' ' ' SER . 1.2 p 158.48 0.19 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.522 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -66.06 -20.76 66.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.592 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.15 -38.7 80.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.459 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.65 -46.91 86.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.815 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.13 -43.75 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 -179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.5 mt -62.74 -42.85 97.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -54.89 -47.32 74.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.658 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -62.02 -43.17 99.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.029 0.442 . . . . 0.0 110.516 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.7 mt -59.51 -44.25 92.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.72 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.74 -40.95 98.84 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.02 0.438 . . . . 0.0 110.243 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 59.3 ttt85 -54.65 -45.34 73.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.532 -179.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -65.02 -41.45 95.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.603 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 94' ' ' GLY . 9.5 mt -66.43 -39.56 89.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.479 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 95' ' ' ASP . . . -55.62 -46.46 77.38 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.184 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -61.68 -52.14 65.53 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.028 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.1 t -66.02 -25.84 36.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -86.7 -29.15 24.67 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.446 ' N ' ' O ' ' A' ' 91' ' ' ALA . 38.7 t70 -61.34 -45.84 92.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.785 0.326 . . . . 0.0 110.727 -179.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 90.0 p -136.45 104.91 5.74 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.934 0.397 . . . . 0.0 110.466 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 39.1 ttp -127.35 -16.86 4.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.373 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.461 ' O ' ' O ' ' A' ' 101' ' ' ILE . 98.5 m-20 -64.9 -31.5 72.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.575 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -65.09 -40.4 94.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.186 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m -60.57 -44.16 96.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.943 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.461 ' O ' ' O ' ' A' ' 98' ' ' ASP . 2.8 pt -99.81 149.53 36.02 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.066 -179.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -36.64 104.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.352 0 C-N-CA 122.548 2.166 . . . . 0.0 112.12 179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -77.87 179.52 6.42 Favored 'Trans proline' 0 C--N 1.314 -1.269 0 C-N-CA 122.243 1.962 . . . . 0.0 112.023 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 91.1 -16.27 59.05 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 45.0 mt -68.89 -32.55 72.28 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.871 0.367 . . . . 0.0 110.31 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 12.2 p -59.53 -32.9 50.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.532 -179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -61.9 -44.72 96.21 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.067 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.89 -41.09 91.34 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.76 -44.31 96.51 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.145 0.498 . . . . 0.0 110.401 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.04 93.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.61 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.402 ' O ' ' N ' ' A' ' 115' ' ' ASN . 63.7 mt -63.28 -41.49 99.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.628 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . 0.471 ' O ' HG22 ' A' ' 116' ' ' THR . 85.4 mm-40 -58.18 -47.34 83.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.455 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 64.6 tp -68.73 -43.46 75.87 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 121.544 0.688 . . . . 0.0 110.31 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -65.56 -37.52 86.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.216 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 111' ' ' LEU . 40.0 t30 -63.9 -44.35 93.25 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.028 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 112' ' ' GLN . 10.0 t -87.07 28.26 0.94 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.793 0.33 . . . . 0.0 110.416 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 84.7 p -78.84 -3.19 43.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.355 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 44.4 ptt85 -74.96 50.36 0.46 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.489 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.2 m 56.93 95.92 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.661 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 77.2 tt0 -168.6 64.45 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.113 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.489 ' C ' ' H ' ' A' ' 123' ' ' ARG . 7.0 pt-20 -179.02 -171.69 0.22 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.197 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 57.82 3.71 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.511 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.489 ' H ' ' C ' ' A' ' 121' ' ' GLU . 88.5 mtm180 -75.32 -71.31 0.37 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.476 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.475 ' O ' ' N ' ' A' ' 126' ' ' ASP . 99.1 m-20 -64.83 -39.55 93.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.451 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 5.7 tpt180 -66.18 66.92 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.45 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.475 ' N ' ' O ' ' A' ' 124' ' ' ASN . 65.1 t0 -134.18 -85.59 0.42 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.836 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 65.9 mt -54.49 -31.44 55.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.714 0.292 . . . . 0.0 110.671 -179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -55.16 -47.06 75.69 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.421 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 23.4 m -63.68 -44.21 94.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.959 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.9 -47.74 81.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.615 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.95 -41.16 95.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.415 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -61.7 -48.88 78.77 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.98 -44.61 95.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.658 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 57.2 tp -61.78 -53.32 57.57 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.306 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.568 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -59.68 -38.92 82.82 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.463 -0.495 . . . . 0.0 109.857 -178.112 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -57.49 -36.97 72.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.624 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -117.3 62.6 0.74 Allowed 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.743 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.665 ' N ' ' CD ' ' A' ' 139' ' ' PRO . 1.9 t80 -84.88 -34.56 0.53 Allowed Pre-proline 0 CA--C 1.542 0.673 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.239 178.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.665 ' CD ' ' N ' ' A' ' 138' ' ' TYR . 39.8 Cg_exo -55.79 108.9 0.36 Allowed 'Trans proline' 0 N--CA 1.494 1.507 0 C-N-CA 122.024 1.816 . . . . 0.0 111.75 -178.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.416 ' O ' ' N ' ' A' ' 142' ' ' MET . 20.3 ptp180 -153.72 152.3 30.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.248 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.524 ' O ' ' N ' ' A' ' 143' ' ' GLU . 99.7 m-20 43.53 -97.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.384 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . 0.416 ' N ' ' O ' ' A' ' 140' ' ' ARG . 30.5 ttm 63.88 -65.33 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.527 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.811 ' O ' HG23 ' A' ' 147' ' ' THR . 22.6 pt-20 -53.87 -35.32 61.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.197 0.522 . . . . 0.0 110.718 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . 0.488 ' O ' ' OG1' ' A' ' 147' ' ' THR . 47.1 tttp -64.16 -34.82 78.96 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.281 0.563 . . . . 0.0 111.147 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -67.78 -48.9 65.04 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.773 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.452 ' O ' HG23 ' A' ' 150' ' ' VAL . 46.4 pttt -70.31 -31.69 69.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.004 0.43 . . . . 0.0 110.367 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . 0.811 HG23 ' O ' ' A' ' 143' ' ' GLU . 12.2 p -60.11 -45.92 91.37 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.032 -178.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.0 mtm -62.49 -46.06 90.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 119.797 -0.761 . . . . 0.0 110.059 179.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.419 HD22 ' N ' ' A' ' 149' ' ' LEU . 4.2 mm? -65.35 -47.41 76.55 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 119.591 -0.844 . . . . 0.0 110.256 178.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 146' ' ' LYS . 45.7 t -60.89 -41.08 87.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.212 -0.903 . . . . 0.0 109.561 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 46.1 tp -57.79 -45.21 86.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.629 -179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.01 -41.26 95.52 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.613 -179.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.69 -43.51 98.72 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.607 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 77.9 mt -60.78 -43.54 97.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.161 0.505 . . . . 0.0 110.031 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.541 ' O ' HD13 ' A' ' 155' ' ' LEU . 0.2 OUTLIER -62.56 -44.48 96.24 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.685 -179.552 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.73 -35.99 75.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.495 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.14 -48.85 79.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.453 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -64.0 -40.72 97.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.916 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 155' ' ' LEU . 76.9 t -66.32 -46.11 87.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.931 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -66.06 -36.06 82.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.962 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 19.6 p -159.17 162.92 36.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.548 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -88.87 -161.61 0.77 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 12.9 p -84.95 147.84 49.26 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.973 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -41.48 -71.79 0.05 OUTLIER 'Trans proline' 0 N--CA 1.49 1.31 0 C-N-CA 122.284 1.99 . . . . 0.0 112.456 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . 0.54 ' OG ' ' N ' ' A' ' 166' ' ' LEU . 4.9 t 170.59 -111.05 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.997 -179.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.54 ' N ' ' OG ' ' A' ' 165' ' ' SER . 85.6 mt -98.95 -7.75 26.56 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.009 0.433 . . . . 0.0 110.728 -179.806 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 167' ' ' LEU . 10.4 mp -65.91 -25.73 67.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.123 179.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -59.93 -41.99 92.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.698 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -68.25 -46.37 70.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.124 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 78.8 t -62.08 -45.94 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.473 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -60.05 -39.31 85.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.371 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.51 -49.25 78.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.348 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 23.8 m -61.07 -46.86 88.93 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.062 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.3 m -52.66 -42.42 64.7 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.125 -178.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.4 -44.34 99.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.773 0.321 . . . . 0.0 110.688 179.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -70.88 -35.79 72.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.091 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -58.03 -42.15 84.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.41 -179.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.5 mt -60.84 -42.17 91.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.356 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.704 ' ND2' HH21 ' A' ' 183' ' ' ARG . 3.4 m120 -50.79 -34.19 26.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.985 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.461 ' O ' ' O ' ' A' ' 179' ' ' ASN . 57.6 tt0 -35.13 -95.73 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.734 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -130.5 -12.5 3.91 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.63 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.48 ' O ' HG23 ' A' ' 186' ' ' VAL . 56.6 mt -61.95 -36.19 80.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.398 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . 0.704 HH21 ' ND2' ' A' ' 179' ' ' ASN . 42.2 ttm180 -51.32 -45.78 62.36 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.406 -0.518 . . . . 0.0 109.965 -178.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 21.1 m -62.63 -51.29 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.121 0.486 . . . . 0.0 110.008 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -62.08 -40.33 95.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.203 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 182' ' ' LEU . 42.0 t -62.7 -44.2 99.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.616 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 67.2 mmt-85 -58.05 -53.62 56.23 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.148 -178.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 69.1 m -58.56 -40.92 84.42 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.497 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 84.8 mt -86.27 84.37 7.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.386 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . 44.7 -165.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.431 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 10.5 ptp85 -141.02 147.21 38.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.372 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -90.49 108.44 19.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.666 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -62.33 -43.27 99.31 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 50.4 ttp -163.62 144.07 8.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.765 0.317 . . . . 0.0 110.607 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.542 179.897 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -63.53 -41.17 98.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.69 0.281 . . . . 0.0 110.834 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -87.65 138.33 31.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.563 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 72.3 p -79.6 65.78 4.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.561 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.9 p -77.29 161.57 28.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.514 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.498 ' CG ' ' N ' ' A' ' 67' ' ' SER . 16.5 t-80 -154.08 -101.23 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.572 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.498 ' N ' ' CG ' ' A' ' 66' ' ' HIS . 54.1 m -83.36 -8.19 59.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.692 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -63.59 -40.65 97.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.588 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.02 -42.17 99.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.612 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 58.45 -87.74 0.02 OUTLIER Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.022 -0.831 . . . . 0.0 111.022 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.412 ' HE ' ' HB2' ' A' ' 75' ' ' ASP . 33.4 ptt-85 -145.86 156.71 43.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.783 0.325 . . . . 0.0 110.668 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 19.5 tt -139.18 155.09 26.09 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.331 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 65.93 35.66 6.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.149 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -167.89 1.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.686 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.486 ' O ' ' N ' ' A' ' 77' ' ' GLU . 29.8 t70 -158.13 -106.07 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.402 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.402 ' N ' ' CG ' ' A' ' 75' ' ' ASP . 3.7 t 41.55 22.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.651 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.486 ' N ' ' O ' ' A' ' 75' ' ' ASP . 83.1 tt0 -139.65 75.06 1.49 Allowed 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.508 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 1.4 t 171.44 -37.54 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.428 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.49 -34.54 77.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.406 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -60.13 -39.51 86.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.325 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -62.12 -46.16 90.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.445 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 97.4 mt -65.69 -43.73 93.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.604 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.2 mt -60.69 -41.73 89.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -58.36 -55.05 40.03 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 119.84 -0.744 . . . . 0.0 109.803 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -52.86 -52.25 57.99 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.668 -178.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.59 -51.21 73.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.043 179.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' A' ' 91' ' ' ALA . . . -57.36 -36.86 71.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.26 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -61.87 -45.91 91.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.526 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -66.02 -43.29 88.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.931 0.396 . . . . 0.0 110.14 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.558 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.8 mp -71.42 -33.69 69.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.048 178.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.486 ' N ' ' O ' ' A' ' 87' ' ' ALA . . . -56.9 -48.43 78.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.439 -179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -72.18 -52.54 16.07 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.906 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 88.3 t -66.68 -26.33 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 121.039 0.447 . . . . 0.0 110.745 -179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -75.97 -37.04 39.51 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -64.13 -47.6 79.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.495 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.3 p -106.16 106.67 17.29 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.993 0.425 . . . . 0.0 110.383 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.462 ' SD ' ' O ' ' A' ' 97' ' ' MET . 2.3 tmm? -171.0 -32.6 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 98' ' ' ASP . 35.5 p-10 -65.67 -22.87 66.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.956 -179.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -60.5 -38.57 84.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 38.7 t -62.92 -42.48 99.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.621 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 6.4 pt -144.33 76.34 14.75 Favored Pre-proline 0 N--CA 1.463 0.205 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.343 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -45.22 106.42 0.09 OUTLIER 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.434 2.089 . . . . 0.0 111.839 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.98 -163.93 0.25 Allowed 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.433 2.089 . . . . 0.0 112.274 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 87.32 -18.85 34.73 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.942 -0.863 . . . . 0.0 110.942 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 47.0 mt -66.78 -41.62 87.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.007 0.432 . . . . 0.0 110.383 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.45 HG22 ' H ' ' A' ' 106' ' ' VAL . 3.2 m -66.44 -37.74 80.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.71 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -62.43 -41.31 98.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.033 0.444 . . . . 0.0 110.194 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -67.89 -48.72 53.11 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.348 -1.101 . . . . 0.0 110.348 179.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.34 -41.47 98.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.142 0.496 . . . . 0.0 110.335 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.46 -48.44 74.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.337 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 45.3 tp -63.73 -43.11 97.49 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.615 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -61.78 -34.93 76.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.728 -179.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 113' ' ' LEU . 40.0 mt -62.73 -42.68 99.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.31 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -78.12 -20.75 51.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.882 0.372 . . . . 0.0 110.169 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -62.73 -34.79 77.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.307 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.2 m -60.11 -47.93 83.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.656 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.5 m -87.74 -76.25 0.38 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.914 0.388 . . . . 0.0 110.361 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 53.6 ttt-85 45.55 33.01 1.25 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.711 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 24.9 m -171.9 -38.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.521 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 40.7 tp10 -64.97 -39.14 93.04 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.474 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -66.64 -35.6 80.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.786 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -80.13 88.0 5.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 15.7 tpt85 -174.0 -66.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.471 179.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -63.34 -41.29 98.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.524 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -75.99 -5.67 47.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.613 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -48.96 -69.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 -179.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.7 mt -65.4 -34.71 78.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.729 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.42 -44.68 72.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.417 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 19.6 m -63.73 -46.56 84.82 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.401 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.19 -43.45 95.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.771 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 81.2 mt -61.64 -43.6 98.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.79 0.329 . . . . 0.0 110.22 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -68.65 -46.42 69.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.288 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -62.02 -51.49 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.748 -179.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 43.5 tp -63.7 -47.9 79.29 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.855 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 43.5 tp -59.33 -28.54 66.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.898 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 -55.41 -25.29 35.02 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.169 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -93.76 -92.26 0.18 Allowed 'General case' 0 C--N 1.333 -0.113 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.496 ' O ' ' CD2' ' A' ' 138' ' ' TYR . 83.6 t80 61.29 64.7 2.07 Favored Pre-proline 0 C--O 1.231 0.125 0 CA-C-O 120.948 0.404 . . . . 0.0 110.878 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.415 ' O ' ' O ' ' A' ' 140' ' ' ARG . 73.0 Cg_endo -84.49 -36.79 0.15 Allowed 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.101 1.867 . . . . 0.0 112.257 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.415 ' O ' ' O ' ' A' ' 139' ' ' PRO . 75.3 mtp180 -52.64 -171.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.562 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 54.81 33.51 19.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.798 179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 36.2 ttm -125.57 -58.19 1.43 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.791 0.329 . . . . 0.0 110.601 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -66.32 -35.35 80.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.566 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 20.6 tptt -60.58 -34.06 73.64 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.146 0.498 . . . . 0.0 110.457 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -76.56 -35.92 57.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.529 178.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -68.54 -47.13 67.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.555 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 73.3 m -61.92 -42.63 99.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.116 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 48.5 tpp -54.76 -46.25 74.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.97 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 94.6 mt -70.06 -46.71 64.39 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.724 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 76.3 t -60.05 -44.75 95.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.542 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.2 tt -61.46 -44.82 96.42 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.042 0.449 . . . . 0.0 110.866 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.48 89.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 43.1 tp -58.46 -40.77 83.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.187 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.46 -43.87 96.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.251 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 96.7 mt -65.48 -46.57 79.24 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.318 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -66.24 -40.39 90.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.095 0.474 . . . . 0.0 110.194 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 161' ' ' SER . 19.3 tptm -64.49 -35.33 80.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.719 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.24 -40.31 95.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.322 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 57.8 t -75.85 -50.24 23.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.865 179.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.65 ' O ' ' N ' ' A' ' 162' ' ' HIS . . . -67.69 -50.1 59.38 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.814 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . 0.452 ' C ' ' O ' ' A' ' 160' ' ' ALA . 66.8 m 25.12 34.56 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.739 0.649 . . . . 0.0 111.487 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.65 ' N ' ' O ' ' A' ' 160' ' ' ALA . 90.0 m-70 -147.88 120.58 8.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.285 -177.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -147.37 175.57 2.65 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.319 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -57.23 -153.95 0.01 OUTLIER 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 122.473 2.115 . . . . 0.0 111.753 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 3.4 m -152.82 -71.19 0.15 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.416 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 57.4 mt -64.34 -39.91 94.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.538 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.39 -37.52 87.61 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.405 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -59.74 -44.94 93.56 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.577 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -64.45 -44.12 92.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.95 0.405 . . . . 0.0 110.709 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 92.9 t -64.42 -44.16 97.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.786 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -59.92 -42.18 93.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.419 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -59.9 -49.3 78.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.493 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 18.8 m -59.41 -46.19 89.4 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.058 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 84.6 m -52.57 -44.99 66.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.825 -178.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 75.0 t -58.93 -41.69 83.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.078 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . 0.403 ' OD1' ' O ' ' A' ' 176' ' ' ASN . 55.5 t-20 -61.49 -39.5 91.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.706 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -59.01 -41.26 87.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.69 0.281 . . . . 0.0 110.676 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 36.0 mm -61.88 -40.91 88.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.236 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -64.59 -35.9 82.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.094 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -54.92 -102.42 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.844 0.354 . . . . 0.0 111.068 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 41.9 p-10 -80.88 72.32 7.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.775 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 63.1 tp -64.14 -42.76 96.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.723 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -60.51 -38.33 84.01 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.836 -0.345 . . . . 0.0 110.531 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 72.5 m -59.14 -44.95 92.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.229 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -61.84 -39.63 92.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.452 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 77.4 t -60.67 -48.72 87.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.513 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -63.82 -32.79 74.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.27 0.557 . . . . 0.0 110.687 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 16.3 m -57.34 -33.21 67.51 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.287 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.481 ' O ' ' HB3' ' A' ' 190' ' ' ALA . 4.1 mm? -87.45 -4.01 59.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.525 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 193' ' ' GLY . . . 67.11 41.4 2.62 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.486 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 79.2 ttt-85 -65.12 -38.99 92.42 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.338 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -59.34 -40.19 85.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.464 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . 0.482 ' O ' ' HB1' ' A' ' 190' ' ' ALA . . . -160.37 165.24 34.85 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . 0.421 ' HG2' ' H ' ' A' ' 194' ' ' MET . 14.7 ptp -71.57 150.28 44.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.735 0.302 . . . . 0.0 110.373 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.567 -179.993 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -63.5 -41.88 98.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 0.0 110.621 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.439 ' C ' ' H ' ' A' ' 65' ' ' SER . 63.0 ttm-85 -65.48 -42.13 92.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.326 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.2 p -76.41 35.61 0.15 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.77 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.439 ' H ' ' C ' ' A' ' 63' ' ' ARG . 38.5 t -63.68 -16.78 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.538 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.0 m80 49.59 -111.16 0.46 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.491 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.9 t -158.67 151.97 22.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.587 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -80.55 136.85 36.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.359 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.2 mt -116.18 123.75 48.57 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.219 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -108.89 -159.2 19.23 Favored Glycine 0 N--CA 1.463 0.444 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -70.74 134.88 47.82 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.895 0.379 . . . . 0.0 110.573 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.448 ' CG1' ' N ' ' A' ' 73' ' ' GLU . 16.5 tt -134.79 166.08 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.602 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.448 ' N ' ' CG1' ' A' ' 72' ' ' ILE . 97.0 mt-10 -46.99 -45.62 21.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.49 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.63 ' O ' ' N ' ' A' ' 76' ' ' SER . . . -40.0 -75.79 0.03 OUTLIER 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.674 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 79' ' ' GLN . 67.6 t0 40.72 -83.12 0.0 OUTLIER 'General case' 0 CA--C 1.526 0.055 0 O-C-N 123.53 0.519 . . . . 0.0 111.069 179.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.63 ' N ' ' O ' ' A' ' 74' ' ' ALA . 48.1 t -57.13 -44.07 82.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.313 179.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -68.67 -34.32 75.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.345 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.0 p -118.55 43.8 2.42 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.321 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.52 ' N ' ' O ' ' A' ' 75' ' ' ASP . 56.3 tt0 -61.97 -43.24 99.26 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.489 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -67.33 -33.77 75.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.506 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -60.5 -37.38 80.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.603 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 93.6 mt -62.7 -44.36 99.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.38 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.6 mt -63.79 -44.7 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -55.59 -43.89 76.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.857 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.458 ' OD1' ' CD2' ' A' ' 89' ' ' HIS . 45.9 t-20 -63.97 -42.52 97.21 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 121.003 0.43 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.7 mt -60.3 -44.49 95.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.111 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.6 -50.34 73.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.963 0.411 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 94.1 mtm-85 -54.07 -45.95 71.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.122 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.458 ' CD2' ' OD1' ' A' ' 85' ' ' ASN . 36.1 m-70 -66.93 -41.82 86.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.075 0.464 . . . . 0.0 110.221 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.693 ' O ' HD23 ' A' ' 90' ' ' LEU . 3.2 tt -64.58 -41.7 96.09 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.099 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.92 -41.17 82.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.396 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -65.24 -52.21 55.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.423 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.8 t -71.39 -26.4 26.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.045 0.45 . . . . 0.0 110.657 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.54 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -79.91 -40.73 13.73 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -65.45 -47.08 77.41 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.663 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 78.0 p -75.0 -31.24 61.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.606 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 54.92 -170.54 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.257 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.641 ' C ' ' H ' ' A' ' 100' ' ' SER . 51.7 t0 -86.35 2.25 48.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 60.66 -10.4 0.06 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.654 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.641 ' H ' ' C ' ' A' ' 98' ' ' ASP . 36.9 m -80.38 -17.58 51.47 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.952 0.406 . . . . 0.0 110.08 179.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 3.3 pt -45.84 142.04 3.92 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.861 -179.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -37.19 100.67 0.03 OUTLIER 'Trans proline' 0 C--N 1.317 -1.104 0 C-N-CA 122.685 2.257 . . . . 0.0 112.363 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -80.81 155.6 20.55 Favored 'Trans proline' 0 C--N 1.312 -1.375 0 C-N-CA 122.615 2.21 . . . . 0.0 112.173 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 96.73 -29.51 10.35 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.534 HD12 ' N ' ' A' ' 105' ' ' LEU . 10.3 mp -64.78 -35.21 80.36 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.874 0.368 . . . . 0.0 110.016 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 107' ' ' ASN . 12.6 p -50.48 -36.32 13.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.399 -178.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.432 ' N ' HG13 ' A' ' 106' ' ' VAL . 98.5 m-20 -61.25 -40.07 92.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.871 0.367 . . . . 0.0 110.159 179.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -56.05 -39.89 81.08 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.789 -0.925 . . . . 0.0 110.789 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 109' ' ' LEU . 9.6 mp -63.58 -42.78 98.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.519 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.64 -39.02 86.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.9 -39.8 95.02 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.358 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -57.98 -47.74 82.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.761 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 5.1 tp -60.79 -21.83 63.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.618 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -87.73 -55.49 3.75 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.587 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -64.99 -39.63 93.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.7 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 32.8 m -67.07 89.77 0.18 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.722 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 35.1 p -152.16 16.19 0.64 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.651 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.529 ' O ' ' N ' ' A' ' 120' ' ' GLU . 14.5 ptp180 -125.44 138.2 54.0 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.662 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.6 m -48.17 88.62 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.425 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.529 ' N ' ' O ' ' A' ' 118' ' ' ARG . 72.2 mm-40 -142.74 -63.13 0.42 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.785 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -71.06 69.65 0.5 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.183 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -173.88 -38.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.621 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -69.4 -39.68 77.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.132 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -67.6 -49.15 64.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.45 -179.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -77.07 -10.48 59.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.735 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -45.13 -85.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.743 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.6 mt -51.48 -35.76 41.37 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.742 0.306 . . . . 0.0 110.672 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.98 70.15 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.225 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 99.7 m -63.29 -42.12 99.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.105 179.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.01 80.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.15 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -59.96 -42.37 93.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.825 0.345 . . . . 0.0 110.339 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -63.94 -49.96 70.54 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.232 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.82 -36.45 83.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.498 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.62 -55.04 39.4 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.445 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.27 -31.65 70.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.977 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -56.43 -26.95 55.27 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.112 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -159.65 57.09 0.38 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.275 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.503 ' CG ' ' O ' ' A' ' 138' ' ' TYR . 22.2 p90 -83.22 122.44 77.41 Favored Pre-proline 0 CA--C 1.54 0.596 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.733 -179.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.443 ' O ' ' O ' ' A' ' 140' ' ' ARG . 63.8 Cg_endo -77.69 -78.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.462 0 C-N-CA 122.024 1.816 . . . . 0.0 112.39 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.508 ' O ' ' N ' ' A' ' 142' ' ' MET . 39.5 ttm180 58.57 145.59 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.381 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -45.6 91.72 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.401 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . 0.508 ' N ' ' O ' ' A' ' 140' ' ' ARG . 47.9 ttp -128.79 -39.21 1.63 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.542 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 38.6 tp10 -65.26 -44.6 87.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.469 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 13.1 tptp -61.57 -49.58 76.08 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.254 -0.578 . . . . 0.0 109.784 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -55.44 -35.24 65.23 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.757 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -69.17 -49.85 52.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.209 0.528 . . . . 0.0 110.884 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 54.4 m -71.0 -41.21 71.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.762 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 53.1 ttm -52.88 -46.17 67.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.228 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 75.8 mt -63.91 -49.77 71.36 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.292 179.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.24 -45.06 99.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.56 HD13 ' O ' ' A' ' 151' ' ' LEU . 0.2 OUTLIER -61.99 -46.68 88.17 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.184 0.516 . . . . 0.0 110.321 -179.293 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -59.03 -41.27 87.38 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.146 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 49.1 tp -59.75 -41.66 91.47 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.334 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.58 -42.86 97.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.004 0.43 . . . . 0.0 110.223 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.73 -46.53 87.64 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.205 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -69.17 -37.21 78.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.556 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . 0.699 ' HZ1' HH12 ' A' ' 168' ' ' ARG . 88.6 tttt -62.29 -45.03 95.08 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.563 -179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -63.03 -38.09 89.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 73.5 t -66.33 -44.79 90.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.569 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.78 81.36 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.362 -179.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 37.7 m -171.1 173.49 5.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.508 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.584 ' ND1' ' N ' ' A' ' 162' ' ' HIS . 0.0 OUTLIER 179.25 69.08 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 84.7 m -116.87 81.7 12.37 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.42 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.436 ' O ' ' CB ' ' A' ' 165' ' ' SER . 73.0 Cg_endo -82.04 -179.44 4.76 Favored 'Trans proline' 0 C--N 1.312 -1.361 0 C-N-CA 122.681 2.254 . . . . 0.0 111.872 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 164' ' ' PRO . 0.7 OUTLIER 79.35 25.65 0.43 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 179.395 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 82.0 mt -143.98 -106.12 0.12 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.849 0.357 . . . . 0.0 110.569 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.696 HD23 ' N ' ' A' ' 167' ' ' LEU . 2.0 pt? -59.59 -26.24 65.26 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.317 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.699 HH12 ' HZ1' ' A' ' 157' ' ' LYS . 55.5 mtp85 -72.18 -40.85 67.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.893 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.03 -47.05 84.7 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.989 0.423 . . . . 0.0 111.275 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.435 HG13 ' N ' ' A' ' 171' ' ' PHE . 5.8 p -65.41 -41.36 90.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.235 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . 0.435 ' N ' HG13 ' A' ' 170' ' ' VAL . 76.7 t80 -61.59 -40.9 96.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.356 179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -58.21 -47.97 81.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.353 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 19.7 m -58.46 -42.5 87.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.896 0.379 . . . . 0.0 110.434 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 72.3 m -57.32 -42.71 82.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.081 0.467 . . . . 0.0 110.305 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.06 -40.95 84.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.359 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -60.56 -39.09 86.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.955 0.407 . . . . 0.0 110.384 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -60.75 -46.62 89.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.984 0.421 . . . . 0.0 110.506 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . 0.599 HG22 HD22 ' A' ' 182' ' ' LEU . 54.5 mt -69.59 -35.76 67.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.649 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -50.09 -34.44 21.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.618 -179.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -65.91 -36.25 82.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.795 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -121.01 38.47 4.05 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.883 0.373 . . . . 0.0 110.508 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.599 HD22 HG22 ' A' ' 178' ' ' ILE . 0.2 OUTLIER -61.64 -43.02 99.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.299 0.571 . . . . 0.0 110.2 -179.147 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.75 -47.28 80.42 Favored 'General case' 0 C--N 1.321 -0.63 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.137 -179.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.4 m -59.2 -43.72 92.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.089 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.2 -38.97 84.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.56 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.3 t -59.75 -49.6 83.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.082 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 91.3 mtt-85 -68.46 -52.33 33.65 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.156 0.503 . . . . 0.0 110.261 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 74.6 m -57.84 -37.04 73.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.115 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.531 ' C ' HD23 ' A' ' 189' ' ' LEU . 3.2 tt -101.46 107.69 19.07 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.085 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . 0.461 ' N ' HD23 ' A' ' 189' ' ' LEU . . . 58.22 117.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.381 179.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -72.21 131.47 42.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.38 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 63.0 t-20 -104.53 112.35 25.38 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.457 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -134.06 -106.6 0.93 Allowed Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 65.6 mtt 49.73 46.1 24.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.812 0.339 . . . . 0.0 110.516 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 68.2 t0 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.543 -179.976 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -63.41 -41.85 98.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.741 0.305 . . . . 0.0 110.452 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.401 ' HE ' ' CE ' ' A' ' 97' ' ' MET . 80.0 mtp85 -140.83 -49.89 0.44 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.449 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m -142.62 119.57 11.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.966 0.412 . . . . 0.0 110.381 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.6 m -160.58 165.16 31.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.375 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.431 ' O ' ' O ' ' A' ' 67' ' ' SER . 74.0 m80 -97.74 99.54 10.89 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.382 179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.431 ' O ' ' O ' ' A' ' 66' ' ' HIS . 88.0 p 39.64 -162.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.815 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 70.9 ttt180 -158.56 109.65 2.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.233 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.575 HD22 ' N ' ' A' ' 69' ' ' LEU . 3.8 mm? -88.5 131.96 34.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.938 0.399 . . . . 0.0 110.679 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 167.07 51.32 0.03 OUTLIER Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.164 -0.775 . . . . 0.0 111.164 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.547 ' N ' ' CD ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -154.36 7.28 0.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.689 0.28 . . . . 0.0 110.759 -179.887 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 16.4 tt -78.97 32.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.284 0.564 . . . . 0.0 110.271 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.428 ' H ' ' C ' ' A' ' 71' ' ' ARG . 97.2 mt-10 56.56 33.66 23.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.582 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -137.71 -3.07 1.88 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 110.697 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -64.62 -33.46 75.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.699 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 78' ' ' SER . 86.7 p -59.59 163.35 4.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.651 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.471 ' C ' ' H ' ' A' ' 79' ' ' GLN . 79.9 tt0 58.66 -75.8 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.416 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 76' ' ' SER . 41.5 t -66.14 4.68 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.543 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.471 ' H ' ' C ' ' A' ' 77' ' ' GLU . 58.8 tt0 -45.36 -36.39 4.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.99 -43.38 98.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.058 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.66 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.005 0.431 . . . . 0.0 110.315 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 86' ' ' ILE . 36.2 mm -63.2 -43.05 98.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.521 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.61 -43.75 98.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.107 0.479 . . . . 0.0 110.227 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.5 ttm-85 -70.58 -55.15 9.51 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.683 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -52.99 -50.52 64.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.088 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.508 HG23 ' N ' ' A' ' 87' ' ' ALA . 4.0 tp -65.12 -45.74 93.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.034 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.508 ' N ' HG23 ' A' ' 86' ' ' ILE . . . -62.63 -36.53 83.08 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.444 -179.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -59.94 -48.65 80.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.572 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -66.58 -40.04 88.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.204 179.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 93' ' ' VAL . 82.0 mt -67.52 -35.06 78.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.891 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.5 -48.27 75.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.239 -179.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -65.87 -52.8 47.13 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 120.124 -0.63 . . . . 0.0 110.573 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 90' ' ' LEU . 3.4 p -66.29 -26.47 38.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.628 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.93 -27.3 29.17 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -73.58 -47.38 41.01 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.798 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 52.0 m -71.02 -5.04 28.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.862 0.363 . . . . 0.0 110.766 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.401 ' CE ' ' HE ' ' A' ' 63' ' ' ARG . 8.2 ttt -62.4 -38.53 90.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -65.43 -33.33 75.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.4 ttt85 -55.58 -44.61 77.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.487 -179.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.6 m -71.85 -23.43 61.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.167 179.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 49.0 mm -118.68 80.23 17.07 Favored Pre-proline 0 N--CA 1.47 0.564 0 CA-C-O 120.808 0.337 . . . . 0.0 110.685 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -48.51 147.49 9.16 Favored 'Trans proline' 0 C--N 1.31 -1.448 0 C-N-CA 122.671 2.247 . . . . 0.0 112.677 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -70.45 152.21 65.58 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.518 2.146 . . . . 0.0 112.381 179.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 83.39 -47.49 3.84 Favored Glycine 0 CA--C 1.524 0.617 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.792 179.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.532 HD12 ' N ' ' A' ' 105' ' ' LEU . 10.9 mp -63.64 -45.72 88.93 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.578 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.553 HG13 ' N ' ' A' ' 107' ' ' ASN . 7.3 p -68.44 -47.04 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.724 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.553 ' N ' HG13 ' A' ' 106' ' ' VAL . 13.5 m120 -68.98 -35.73 77.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.717 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -57.84 -15.94 22.11 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 95.3 mt -63.83 -47.9 78.96 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.824 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.6 -38.54 80.71 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.5 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.5 tp -63.81 -39.36 94.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.824 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.89 -47.74 76.75 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.65 -179.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.483 ' C ' ' N ' ' A' ' 115' ' ' ASN . 4.0 mm? -68.56 -42.31 78.52 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.374 179.155 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -47.7 -14.59 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.075 0.464 . . . . 0.0 110.481 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.483 ' N ' ' C ' ' A' ' 113' ' ' LEU . 10.0 m120 -61.17 -40.72 94.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.395 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 t -68.21 -38.87 82.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.13 0.491 . . . . 0.0 110.714 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 81.1 p -77.88 47.7 0.65 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 51.8 ptt85 -62.29 -35.99 80.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.524 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 12.2 p -76.27 -86.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.643 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -172.69 -51.75 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.547 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 57.83 24.63 11.04 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.837 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -101.12 9.3 42.17 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.797 0.332 . . . . 0.0 110.926 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 85.9 mtm-85 -65.29 -38.19 89.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.071 -179.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -62.85 -44.37 96.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.251 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 17.4 ptp180 -77.79 -7.64 56.88 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.02 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -43.03 -71.7 0.08 Allowed 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.626 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 58.0 mt -62.13 -35.76 79.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 120.639 0.256 . . . . 0.0 110.826 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -54.27 -43.91 71.4 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.092 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . . . . . . . . . 18.9 m -63.32 -47.66 81.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.239 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.58 -47.66 85.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.283 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 89.7 mt -63.05 -40.44 97.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.446 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -59.47 -50.63 73.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.524 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -57.42 -44.7 84.87 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.702 -0.399 . . . . 0.0 109.962 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.91 -48.99 77.95 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.76 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.567 ' O ' HD13 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -58.28 -42.2 86.04 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.94 -178.338 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -61.83 -28.22 69.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.98 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -135.16 94.1 3.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.902 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.468 ' O ' ' CD2' ' A' ' 138' ' ' TYR . 85.4 t80 -157.33 78.36 3.7 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.872 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -45.77 104.12 0.06 OUTLIER 'Trans proline' 0 C--N 1.307 -1.655 0 C-N-CA 122.445 2.097 . . . . 0.0 111.832 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 30.2 mmt180 -45.03 127.36 6.55 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.56 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -79.44 86.23 5.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.958 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 5.8 ptp -145.37 -46.66 0.22 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.031 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -64.02 -49.34 72.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.443 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? -65.85 -40.76 92.01 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.67 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -68.81 -35.3 76.84 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.417 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 150' ' ' VAL . 38.1 ttmt -72.02 -35.82 69.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.912 0.387 . . . . 0.0 110.45 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 77.4 m -59.74 -44.06 93.96 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.025 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 51.0 mtt -61.04 -45.33 95.2 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.492 -0.483 . . . . 0.0 109.737 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.72 -43.14 94.38 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.702 179.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 146' ' ' LYS . 47.3 t -62.1 -43.25 97.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.528 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.28 -44.42 88.46 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.315 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.47 90.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.004 0.43 . . . . 0.0 110.493 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 18.9 tp -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.448 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -47.81 84.12 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.453 . . . . 0.0 110.253 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 52.0 tp -67.14 -45.27 77.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.272 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -64.77 -45.22 87.29 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.618 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.0 -37.81 83.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.286 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -62.54 -43.08 99.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.125 0.488 . . . . 0.0 110.509 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 72.8 t -67.15 -43.83 88.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.335 179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.69 -35.63 80.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.897 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 29.5 m -159.84 161.99 34.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.379 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -98.56 -26.19 14.49 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.736 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 4.3 p 64.04 145.19 0.08 OUTLIER Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.494 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -71.67 155.66 58.5 Favored 'Trans proline' 0 N--CA 1.492 1.436 0 C-N-CA 122.466 2.111 . . . . 0.0 111.943 179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . 0.46 ' O ' ' N ' ' A' ' 167' ' ' LEU . 8.7 t -93.13 -153.58 0.36 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 7.9 tp 66.77 -60.92 0.33 Allowed 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.58 0.55 . . . . 0.0 110.699 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' A' ' 165' ' ' SER . 53.7 mt -63.28 -33.38 75.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.274 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -64.4 -45.83 85.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.553 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -66.12 -43.67 86.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.478 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 82.8 t -63.93 -44.94 98.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.348 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -61.0 -41.34 96.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.45 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 12.6 t-160 -63.45 -49.68 72.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.815 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 16.4 m -61.74 -42.6 99.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.806 0.336 . . . . 0.0 110.432 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.7 m -53.87 -44.09 70.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.585 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 93.4 t -64.29 -42.12 94.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.807 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -72.09 -38.6 69.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.267 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -60.85 -43.02 98.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.796 -179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 95.1 mt -62.32 -39.88 85.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.105 0.479 . . . . 0.0 109.914 179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.486 ' O ' ' O ' ' A' ' 180' ' ' GLN . 61.8 t30 -48.87 -34.15 12.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.816 -179.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . 0.486 ' O ' ' O ' ' A' ' 179' ' ' ASN . 81.7 mm-40 -32.3 -99.33 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 O-C-N 124.043 0.839 . . . . 0.0 110.652 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -128.95 -14.25 4.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.335 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.431 ' O ' HG12 ' A' ' 186' ' ' VAL . 55.5 mt -58.87 -35.24 72.65 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.827 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . 0.466 ' CZ ' ' OD1' ' A' ' 179' ' ' ASN . 44.1 ttm180 -51.0 -42.15 60.17 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.154 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 85.5 m -72.36 -51.49 20.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.793 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -63.68 -49.35 73.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.385 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.431 HG12 ' O ' ' A' ' 182' ' ' LEU . 3.0 p -58.41 -35.01 52.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.148 -179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 59.5 ttt85 -59.68 -52.28 66.18 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 120.415 -0.514 . . . . 0.0 109.903 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 78.2 p -58.73 -48.71 80.22 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.694 -179.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.81 -40.42 95.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.525 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -75.28 67.1 1.84 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.513 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -93.44 3.0 56.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.826 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 45.7 p-10 -86.08 161.36 18.96 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.381 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -159.57 110.33 0.44 Allowed Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . 0.458 ' SD ' ' O ' ' A' ' 194' ' ' MET . 0.0 OUTLIER -84.82 143.44 29.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.67 0.271 . . . . 0.0 110.507 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.614 179.915 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.37 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -64.46 -41.19 96.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.798 0.332 . . . . 0.0 110.712 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -72.48 142.69 48.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.317 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.7 t -61.26 -42.97 99.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.499 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.3 m 61.01 85.08 0.12 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.507 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -82.36 -11.8 58.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.493 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 82.5 p 51.26 -153.87 0.17 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.377 -179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.472 ' O ' ' O ' ' A' ' 69' ' ' LEU . 62.4 ttp180 -138.59 -62.59 0.56 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.559 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.543 HD12 ' N ' ' A' ' 69' ' ' LEU . 10.3 mp 54.65 115.43 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.1 0.476 . . . . 0.0 110.522 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.447 ' O ' ' O ' ' A' ' 71' ' ' ARG . . . -75.68 29.33 1.27 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.039 -0.825 . . . . 0.0 111.039 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.469 ' H ' ' C ' ' A' ' 69' ' ' LEU . 16.5 mmm180 55.06 112.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.963 0.411 . . . . 0.0 110.523 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 14.0 pt -128.79 164.56 30.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.705 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 56.12 31.51 18.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.62 -179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -157.73 -14.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.493 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 40.1 p30 -75.08 -8.01 55.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.489 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 41.4 t -77.26 138.95 39.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.534 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 45.0 27.23 0.26 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.437 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.6 t -162.99 39.63 0.1 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.503 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -65.06 -30.49 71.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.772 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.7 -38.84 82.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.538 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -63.05 -42.36 99.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.464 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.59 -44.78 96.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.415 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 92.4 mt -63.22 -43.66 98.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.92 0.391 . . . . 0.0 110.179 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.414 ' HG2' ' HE ' ' A' ' 88' ' ' ARG . 44.8 ttm180 -52.58 -54.42 33.27 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.825 -179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.526 ' ND2' ' NE2' ' A' ' 89' ' ' HIS . 14.9 t-20 -57.51 -40.94 79.82 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 110.672 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.4 mt -60.24 -52.87 56.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.277 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.54 72.69 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.117 0.484 . . . . 0.0 110.478 -179.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.414 ' HE ' ' HG2' ' A' ' 84' ' ' ARG . 93.9 mtt-85 -61.08 -44.38 97.46 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.474 179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.526 ' NE2' ' ND2' ' A' ' 85' ' ' ASN . 77.7 m-70 -66.38 -44.03 84.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.934 0.397 . . . . 0.0 110.648 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 94' ' ' GLY . 10.3 mp -69.23 -35.09 75.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.572 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.52 -47.96 83.51 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.596 -179.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -67.79 -52.44 37.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.344 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 96.4 t -66.86 -27.22 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.174 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.561 ' N ' ' O ' ' A' ' 90' ' ' LEU . . . -65.83 -39.55 95.15 Favored Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.42 -44.89 95.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.893 0.377 . . . . 0.0 110.632 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.455 ' C ' ' N ' ' A' ' 98' ' ' ASP . 68.9 m -77.32 -3.44 39.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.73 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.4 ttm -49.79 -13.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.528 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.455 ' N ' ' C ' ' A' ' 96' ' ' SER . 88.9 m-20 -66.18 -11.25 48.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.505 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -73.51 -66.04 0.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.612 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.451 ' O ' ' C ' ' A' ' 101' ' ' ILE . 72.1 m -77.29 -70.87 0.44 Allowed 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.47 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.451 ' C ' ' O ' ' A' ' 100' ' ' SER . 1.4 tt 31.01 73.63 0.48 Allowed Pre-proline 0 C--O 1.223 -0.305 0 O-C-N 123.635 0.584 . . . . 0.0 110.97 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -76.88 112.73 3.49 Favored 'Trans proline' 0 C--N 1.298 -2.128 0 C-N-CA 121.973 1.782 . . . . 0.0 111.898 -178.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.499 ' O ' ' N ' ' A' ' 105' ' ' LEU . 72.1 Cg_endo -78.68 -8.44 15.84 Favored 'Trans proline' 0 C--N 1.314 -1.281 0 C-N-CA 122.547 2.165 . . . . 0.0 112.165 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.469 ' C ' ' O ' ' A' ' 103' ' ' PRO . . . -32.29 -35.55 0.02 OUTLIER Glycine 0 N--CA 1.466 0.658 0 N-CA-C 111.395 -0.682 . . . . 0.0 111.395 -179.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' A' ' 103' ' ' PRO . 0.4 OUTLIER -83.95 40.35 0.75 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.179 0.514 . . . . 0.0 110.442 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.449 ' N ' ' O ' ' A' ' 103' ' ' PRO . 0.0 OUTLIER -70.34 -44.57 77.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.024 179.157 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 56.5 t-20 -57.01 -50.0 74.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.348 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -70.42 -46.56 48.01 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.427 ' O ' ' N ' ' A' ' 113' ' ' LEU . 47.2 tp -52.18 -47.75 65.37 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.929 -178.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.32 74.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.275 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.414 ' O ' ' N ' ' A' ' 115' ' ' ASN . 82.4 mt -67.48 -46.88 71.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.005 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -64.4 -33.39 75.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.228 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' A' ' 109' ' ' LEU . 53.6 tp -66.54 -39.26 88.49 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.945 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -91.17 -21.89 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.884 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.426 ' HB3' ' HE ' ' A' ' 118' ' ' ARG . 96.7 m-20 -88.67 4.0 48.74 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 54.0 m -72.43 -38.22 68.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.988 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 36.1 t -58.54 -43.48 89.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.043 -178.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.426 ' HE ' ' HB3' ' A' ' 115' ' ' ASN . 39.5 ptt180 -80.24 -21.85 42.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.046 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.418 ' O ' ' N ' ' A' ' 121' ' ' GLU . 82.4 p -67.64 -147.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.15 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 67.72 -59.63 0.41 Allowed 'General case' 0 C--N 1.332 -0.161 0 O-C-N 123.616 0.572 . . . . 0.0 110.45 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 119' ' ' SER . 17.0 pt-20 -88.51 -12.31 43.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.666 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -73.37 -13.01 61.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.729 -179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -67.98 -38.13 82.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.701 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.42 ' O ' ' N ' ' A' ' 126' ' ' ASP . 97.4 m-20 -62.85 -37.52 87.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.445 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.403 ' O ' ' OG1' ' A' ' 129' ' ' THR . 38.4 mmt-85 -68.93 53.69 0.09 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.519 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 124' ' ' ASN . 38.2 t70 -115.71 -70.9 0.77 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.535 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.5 mt -67.48 -43.56 80.67 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.804 0.335 . . . . 0.0 110.93 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.02 -32.78 74.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.436 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 125' ' ' ARG . 21.4 m -62.33 -52.66 62.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.324 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.53 88.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.117 0.484 . . . . 0.0 110.33 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.7 tp -62.0 -48.69 79.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.25 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.2 tp10 -59.33 -35.02 73.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.239 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -63.63 -40.48 97.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.594 179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 58.0 tp -62.13 -44.34 96.85 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.619 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 135' ' ' LEU . 9.7 mp -74.83 -32.41 61.93 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.658 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -56.95 -41.16 77.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.637 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -122.31 72.55 1.06 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.703 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.449 ' O ' ' CG ' ' A' ' 138' ' ' TYR . 69.0 t80 -174.6 59.0 0.21 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.601 179.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -76.34 110.87 3.15 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.588 2.192 . . . . 0.0 111.741 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 61.7 ttt85 -149.22 143.98 26.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.453 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.94 110.16 3.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 74.6 mtm -101.23 -40.22 7.26 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.566 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.517 ' OE1' ' N ' ' A' ' 144' ' ' LYS . 7.1 tm-20 -70.71 -47.0 62.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.93 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . 0.517 ' N ' ' OE1' ' A' ' 143' ' ' GLU . 10.4 tptm -62.71 -48.42 79.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.841 -179.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -58.54 -50.78 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.355 -179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' LYS . . . . . 0.416 ' O ' HG23 ' A' ' 150' ' ' VAL . 55.3 mtpt -63.48 -39.06 93.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.533 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . . 74.9 m -59.89 -46.86 88.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.567 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 75.6 mtm -64.58 -41.9 95.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.585 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 78.0 mt -63.69 -44.26 94.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.968 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 146' ' ' LYS . 72.4 t -66.93 -43.14 89.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.432 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 55.4 tp -59.11 -46.6 87.89 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.474 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.6 -38.81 90.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.263 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.7 tp -63.68 -41.26 98.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.463 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 64.8 mt -60.22 -43.09 96.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.208 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.35 -41.84 98.87 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.242 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -70.87 -33.45 70.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.256 0.551 . . . . 0.0 110.502 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -72.46 -44.2 62.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.343 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -64.06 -48.2 77.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.489 -179.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 160' ' ' ALA . 14.9 p -62.18 -36.84 76.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.249 -179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 161' ' ' SER . . . -60.97 -51.35 69.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.625 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 162' ' ' HIS . 23.7 p -24.14 141.47 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.793 0.683 . . . . 0.0 110.684 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.57 ' CG ' ' O ' ' A' ' 161' ' ' SER . 2.5 m-70 168.51 -38.55 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -79.36 156.68 75.97 Favored Pre-proline 0 N--CA 1.453 -0.321 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.384 -179.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.98 144.61 88.29 Favored 'Trans proline' 0 C--N 1.309 -1.524 0 C-N-CA 122.61 2.206 . . . . 0.0 111.713 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' SER . . . . . . . . . . . . . 85.0 p -91.74 -8.52 46.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.551 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 65.6 mt -61.0 -55.51 32.07 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.45 -179.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 54.3 tp -61.54 -42.28 98.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.235 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -65.39 -39.42 92.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.628 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' ASP . . . . . 0.449 ' O ' HG23 ' A' ' 173' ' ' THR . 99.7 m-20 -62.88 -46.63 86.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.997 -179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.477 ' O ' ' OG1' ' A' ' 173' ' ' THR . 77.1 t -64.3 -44.28 97.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.228 0.537 . . . . 0.0 110.17 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -57.62 -45.56 85.23 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.238 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 26.4 m-70 -65.51 -41.88 92.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.86 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 170' ' ' VAL . 18.6 p -58.82 -46.59 87.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.325 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 91.3 m -58.42 -43.96 88.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.029 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' VAL . . . . . . . . . . . . . 69.9 t -59.71 -43.4 91.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.193 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -60.94 -39.73 90.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.655 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -60.91 -46.66 89.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.821 0.343 . . . . 0.0 110.483 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.99 -41.55 92.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.36 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.428 ' O ' ' CB ' ' A' ' 183' ' ' ARG . 12.8 m120 -49.13 -34.42 14.08 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.354 -179.114 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -43.48 -30.59 0.58 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.124 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -107.87 -50.34 3.07 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.885 0.374 . . . . 0.0 110.914 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.524 HD22 ' N ' ' A' ' 182' ' ' LEU . 4.1 mm? -60.68 -37.01 80.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.553 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' ARG . . . . . 0.583 HH12 ' NH1' ' A' ' 187' ' ' ARG . 73.8 ttt-85 -53.82 -41.37 67.27 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.379 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 17.2 m -60.29 -51.98 67.21 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.644 -179.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -67.92 -39.57 83.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.046 0.45 . . . . 0.0 110.745 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' VAL . . . . . . . . . . . . . 61.5 t -67.08 -42.47 88.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.705 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 187' ' ' ARG . . . . . 0.583 ' NH1' HH12 ' A' ' 183' ' ' ARG . 62.3 ttp180 -60.28 -45.23 94.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.773 -179.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 36.2 t -58.89 -51.22 70.96 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.762 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 189' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 189' ' ' LEU . 4.0 mm? -65.95 -40.39 91.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.674 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -171.42 -113.43 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.393 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -174.09 -54.04 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.713 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -81.25 142.97 32.63 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.556 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -143.98 17.33 2.16 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 194' ' ' MET . . . . . . . . . . . . . 87.2 mtp -83.1 139.75 33.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.824 0.345 . . . . 0.0 110.543 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 65.6 t0 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.961 -1.018 . . . . 0.0 110.58 -179.941 . . . . . . . . 0 0 . 1 stop_ save_