data_2mv3_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 2mv3 _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 103' ' ' MET . . . . . . . . . . . . . 86.3 mtp . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.833 0.349 . . . . 2.1400000000000001 110.939 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.9 mt -56.15 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 1.24 110.804 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.03 79.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.333 -0.394 . . . . 1.04 111.295 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.5 m -53.5 -52.29 60.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 1.0700000000000001 111.395 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -45.16 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.31 -0.404 . . . . 2.6000000000000001 110.928 -179.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.11 -40.41 89.59 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.794 -0.362 . . . . 1.1499999999999999 110.67 -178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.38 -44.56 88.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 2.25 110.32 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.24 -45.52 92.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.13 -0.486 . . . . 2.02 110.53 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.59 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 1.03 110.589 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -59.04 -41.34 87.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 2.1200000000000001 110.923 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -58.81 -45.62 89.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.178 0.513 . . . . 2.9500000000000002 110.062 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -127.24 106.65 9.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 1.1299999999999999 110.225 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.1 mt -93.72 -11.89 30.45 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.806 0.669 . . . . 1.0600000000000001 112.806 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -92.29 14.98 14.76 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.894 0.702 . . . . 1.04 112.894 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.4 t -109.11 94.83 15.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 119.197 -0.43 . . . . 0.87 110.298 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -48.78 -31.69 20.17 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.422 1.414 . . . . 0.14000000000000001 113.213 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.72 -56.18 25.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.889 0.376 . . . . 2.02 110.591 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.86 -40.55 80.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 1.03 110.536 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -59.77 -47.47 85.57 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.628 -0.508 . . . . 0.10000000000000001 109.628 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.16 73.6 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 1.03 110.483 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.51 -45.48 91.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.869 -0.605 . . . . 0.98999999999999999 110.297 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -59.63 -43.5 93.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.462 -0.335 . . . . 0.12 110.857 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -57.41 -46.23 83.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.377 0.608 . . . . 0.10000000000000001 110.088 -179.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -46.15 88.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.717 -0.674 . . . . 2.1299999999999999 110.721 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.5 mt -58.11 -43.86 87.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.044 -0.525 . . . . 1.1799999999999999 110.578 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.02 -41.6 96.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 1.02 110.973 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.1 mt -64.3 -46.07 85.19 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.495 -0.482 . . . . 1.05 110.619 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -58.98 -40.06 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.495 -0.32 . . . . 2.27 111.021 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.5 m -85.87 16.32 4.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.219 0.822 . . . . 0.84999999999999998 113.219 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 62.04 50.79 3.9 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.496 0.665 . . . . 2.5699999999999998 110.752 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -124.92 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 115.954 -0.566 . . . . 0.83999999999999997 111.397 177.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -57.57 -39.42 88.54 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.142 1.228 . . . . 0.14999999999999999 111.663 -175.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.99 -37.86 69.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.294 -0.412 . . . . 2.5600000000000001 110.987 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.0 -42.77 80.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.985 0.421 . . . . 0.79000000000000004 109.945 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.9 t -55.45 -41.62 63.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.523 . . . . 1.02 110.306 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.5 t -66.83 -54.67 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 1.05 110.679 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 89.9 p -54.84 -38.92 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.034 0.445 . . . . 1.74 111.259 -175.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 64.5 ttt-85 -73.04 -50.27 23.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 1.03 111.75 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -56.95 -33.23 66.83 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.947 -0.301 . . . . 0.25 111.609 -176.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -76.86 -8.43 57.32 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.459 0.911 . . . . 1.6200000000000001 113.459 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.2 m -84.41 107.26 10.41 Favored Pre-proline 0 CA--C 1.536 0.413 0 CA-C-O 118.714 -0.66 . . . . 1.0700000000000001 110.175 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.7 -15.23 20.05 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 121.242 1.295 . . . . 0.23000000000000001 113.575 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.68 77.23 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 121.221 -0.514 . . . . 0.19 112.953 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -99.4 142.0 15.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-N 117.569 0.684 . . . . 1.03 110.471 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.74 156.13 28.07 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.65 -0.705 . . . . 1.01 111.725 -177.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 63.3 p -140.88 137.82 33.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.333 -0.849 . . . . 0.85999999999999999 110.506 176.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.8 p -125.77 163.18 40.74 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.666 -0.697 . . . . 0.77000000000000002 109.517 177.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -46.04 -45.83 17.1 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.542 1.495 . . . . 0.22 112.331 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.29 -43.4 88.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 2.04 110.344 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.61 -41.62 90.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.939 0.4 . . . . 0.92000000000000004 110.551 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.18 -45.79 86.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.989 0.423 . . . . 1.03 110.387 -178.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.73 -45.17 90.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.517 . . . . 1.1100000000000001 110.288 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.2 mt -58.41 -43.06 88.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.246 0.546 . . . . 1.05 110.45 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.52 -45.25 89.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.039 -0.528 . . . . 0.84999999999999998 110.402 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.29 -45.03 84.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.03 -0.532 . . . . 1.3100000000000001 110.468 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.33 -46.34 86.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.092 -0.504 . . . . 1.8500000000000001 110.448 -178.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.29 90.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 1.04 110.348 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.38 -42.79 78.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 1.0600000000000001 110.613 -178.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.76 -47.39 84.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 1.45 110.227 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -56.32 -41.68 76.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.874 -0.603 . . . . 2.3199999999999998 111.338 -176.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.6 pt -89.54 13.95 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 113.574 0.953 . . . . 1.05 113.574 -175.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 69.32 25.3 75.59 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 121.366 -0.445 . . . . 0.20999999999999999 113.027 173.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 117.359 0.579 . . . . 2.5299999999999998 110.211 176.408 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.2 mtp . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.936 0.398 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.9 mt -56.32 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.787 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.12 78.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.282 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.5 -52.97 57.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.302 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.87 -44.35 82.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.014 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.41 -40.13 89.89 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.665 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.82 -44.5 86.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.877 0.37 . . . . 0.0 110.382 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -61.52 -48.04 82.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.541 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.69 90.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 -179.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.3 t-20 -61.45 -44.95 96.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.082 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -59.43 -45.28 92.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.988 0.423 . . . . 0.0 110.179 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -125.36 109.47 12.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.318 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 28.0 mt -96.76 -11.96 24.33 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -89.09 13.72 12.41 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.5 t -107.99 94.78 13.41 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.19 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -48.84 -36.06 32.69 Favored 'Trans proline' 0 N--CA 1.497 1.695 0 C-N-CA 121.366 1.378 . . . . 0.0 113.057 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.38 -54.43 46.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.3 84.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.557 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.56 -46.42 88.95 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.695 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.71 -46.73 74.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.944 0.402 . . . . 0.0 110.472 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.39 93.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.217 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -59.18 -45.02 92.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.976 0.417 . . . . 0.0 110.839 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -57.63 -46.4 84.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.254 0.55 . . . . 0.0 110.084 -178.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -58.69 -46.34 87.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.674 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.2 mt -58.33 -43.97 88.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.566 -178.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.27 -41.21 96.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.957 -176.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.11 -46.06 85.88 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.588 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -58.64 -40.98 84.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.759 0.314 . . . . 0.0 110.973 -177.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.2 m -84.58 15.3 3.85 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.4 t30 62.55 50.37 3.61 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.467 0.651 . . . . 0.0 110.87 177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -124.85 49.33 3.14 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.353 177.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -57.19 -39.08 93.15 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.116 1.211 . . . . 0.0 111.751 -174.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.98 -38.06 69.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -68.43 -42.3 79.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.027 0.442 . . . . 0.0 110.08 -179.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.42 -42.77 69.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.181 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -65.97 -52.31 50.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.593 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 86.5 p -54.91 -38.02 67.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.836 0.351 . . . . 0.0 111.199 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -72.44 -53.74 11.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.553 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -56.65 -31.6 64.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -76.82 -13.98 59.95 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -82.32 107.9 10.2 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.201 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -57.56 -16.35 23.74 Favored 'Trans proline' 0 N--CA 1.501 1.946 0 C-N-CA 121.238 1.292 . . . . 0.0 113.484 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.52 77.17 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 121.244 -0.503 . . . . 0.0 112.966 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 75.8 mt -100.02 141.4 17.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 117.57 0.685 . . . . 0.0 110.404 -176.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.39 156.18 26.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.722 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -143.81 137.82 28.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.411 175.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -124.67 165.03 27.24 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.417 177.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -45.91 -44.83 18.17 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 C-N-CA 121.442 1.428 . . . . 0.0 112.508 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.39 -43.81 88.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.269 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.65 -41.22 90.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.646 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.05 -45.4 87.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.356 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.03 -45.97 89.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.127 0.489 . . . . 0.0 110.272 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.6 mt -58.24 -41.6 84.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.63 -179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -59.52 -46.51 88.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.454 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.7 ttp -57.57 -45.03 85.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.44 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.08 -46.16 88.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.501 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.51 92.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.1 mt -56.42 -43.55 79.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.99 0.424 . . . . 0.0 110.625 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.75 -46.23 89.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.222 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 33.0 mtp85 -56.69 -40.65 75.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -176.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.6 pt -87.97 13.98 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -175.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.63 19.57 79.84 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.358 -0.449 . . . . 0.0 113.289 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 117.678 0.739 . . . . 0.0 110.138 176.742 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.3 mmm . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.849 0.357 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.72 -47.12 77.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.037 -178.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.95 -49.09 78.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.457 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.8 m -54.39 -52.29 62.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.95 0.405 . . . . 0.0 111.186 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -44.52 81.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.51 -40.52 91.73 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.679 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -58.34 -44.15 88.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.84 0.352 . . . . 0.0 110.409 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -61.02 -47.07 88.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.542 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.5 -46.23 89.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.676 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -59.49 -42.3 91.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.975 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.5 tttp -59.28 -46.52 88.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.079 0.466 . . . . 0.0 110.053 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -126.49 110.34 13.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.391 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.43 -11.95 26.74 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.13 14.91 14.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 18.9 t -108.13 94.81 13.78 Favored Pre-proline 0 CA--C 1.533 0.29 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.358 178.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -48.87 -34.66 29.08 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.37 1.38 . . . . 0.0 113.071 -174.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.09 -55.2 38.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.894 0.378 . . . . 0.0 110.584 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.09 -41.67 84.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.593 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.4 mm-40 -59.72 -45.89 90.8 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.351 -0.54 . . . . 0.0 109.675 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.73 75.24 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 110.466 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.15 -44.37 92.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.311 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.36 -44.87 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 110.776 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -57.61 -46.39 84.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.277 0.56 . . . . 0.0 110.054 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -45.51 90.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.732 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.6 mt -58.55 -44.66 89.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.513 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -61.11 -40.97 95.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.926 -176.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.9 mt -64.33 -46.04 85.22 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.583 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.07 -40.59 85.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.7 0.286 . . . . 0.0 110.981 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 63.7 m -85.36 17.14 3.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 61.53 50.9 4.3 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.424 0.631 . . . . 0.0 110.751 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.591 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.266 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.25 -39.5 89.6 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.134 1.222 . . . . 0.0 111.707 -174.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.5 -38.41 69.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.935 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.83 -41.88 77.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.969 0.414 . . . . 0.0 110.169 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.55 -42.45 68.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.205 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.6 t -66.44 -52.88 41.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.676 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.8 m -54.46 -38.3 66.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.925 0.393 . . . . 0.0 111.24 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -72.44 -53.62 11.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.487 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -56.46 -31.69 64.24 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.81 -13.19 60.04 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.0 m -84.29 107.73 11.93 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.266 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -57.59 -14.78 17.96 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 121.224 1.282 . . . . 0.0 113.57 -174.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -22.98 77.19 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.932 -177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -100.02 140.74 18.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 117.49 0.645 . . . . 0.0 110.301 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.93 156.1 21.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.754 -176.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -141.79 137.88 31.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.477 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 92.8 p -125.64 163.51 38.45 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.361 177.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -46.0 -44.96 18.37 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.445 1.43 . . . . 0.0 112.488 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -58.76 -44.05 90.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.275 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 60.4 m -59.59 -41.28 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.544 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.81 -45.1 86.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.435 -178.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -59.17 -46.12 89.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.191 0.519 . . . . 0.0 110.272 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 37.0 mt -58.73 -41.6 86.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.621 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -59.14 -46.37 88.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.164 0.507 . . . . 0.0 110.394 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.5 ttp -57.21 -44.56 83.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.527 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.78 -46.65 87.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.511 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.13 -44.0 92.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.279 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 95.8 mt -56.32 -43.35 78.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 110.672 -178.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.37 -46.35 88.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.242 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -57.38 -40.7 78.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.288 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 43.7 pt -89.05 14.06 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.99 24.45 75.81 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.467 -0.397 . . . . 0.0 113.141 173.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 55.6 mtp85 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 117.515 0.658 . . . . 0.0 110.109 176.343 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.2 mtp . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.801 0.334 . . . . 0.0 110.716 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 34.7 mt -55.36 -49.71 71.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 -178.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.07 79.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.487 -175.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.4 m -54.24 -52.83 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 111.26 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 87.4 mmt-85 -57.2 -44.24 83.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.89 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -60.26 -40.47 90.45 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.614 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -58.58 -45.63 88.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.837 0.351 . . . . 0.0 110.398 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.92 -46.82 89.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.616 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.77 90.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -59.0 -43.11 91.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.921 -177.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.71 -47.2 87.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.026 0.441 . . . . 0.0 110.177 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -121.54 108.76 13.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.392 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.0 mt -95.93 -11.88 25.95 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.19 14.92 14.76 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.6 t -108.63 94.87 14.96 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.332 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -48.86 -35.3 30.78 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.373 1.382 . . . . 0.0 113.05 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.56 -55.14 38.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.877 0.37 . . . . 0.0 110.653 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.67 83.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.563 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -59.67 -45.87 90.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.349 -0.541 . . . . 0.0 109.753 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.98 -46.76 75.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.976 0.417 . . . . 0.0 110.386 -176.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.22 92.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.216 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -59.16 -44.98 92.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.85 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -57.65 -46.4 84.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.319 0.58 . . . . 0.0 110.093 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -58.73 -46.34 87.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.638 -178.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.5 mt -58.19 -44.08 87.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 -178.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.4 mt -60.98 -40.99 95.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.8 mt -64.36 -46.09 84.95 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.596 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.87 -40.3 83.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.736 0.303 . . . . 0.0 110.996 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -85.7 16.24 4.12 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 29.5 m120 61.93 51.03 3.89 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.462 0.648 . . . . 0.0 110.715 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.83 49.99 3.67 Favored Pre-proline 0 CA--C 1.541 0.613 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.297 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -56.85 -38.92 94.76 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.18 1.253 . . . . 0.0 111.5 -175.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.12 -38.02 70.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.007 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -68.06 -42.24 80.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.986 0.422 . . . . 0.0 110.122 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.53 -42.38 68.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.17 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.69 -53.34 39.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 -177.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.9 m -54.65 -38.13 66.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.88 0.372 . . . . 0.0 111.212 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.86 -53.38 11.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.521 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -57.69 -30.53 65.56 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.876 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -76.89 -14.27 59.9 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -177.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.5 m -82.66 107.6 9.65 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.199 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.1 -16.98 29.53 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.19 1.26 . . . . 0.0 113.438 -174.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.38 77.01 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.314 -0.47 . . . . 0.0 113.011 -177.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.85 140.37 18.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.52 0.66 . . . . 0.0 110.401 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.7 156.08 24.62 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.621 0.724 . . . . 0.0 111.76 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.3 p -145.29 137.94 26.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.416 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.29 165.02 28.51 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.548 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -45.84 -44.41 18.34 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.467 1.445 . . . . 0.0 112.549 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -59.17 -43.53 92.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.187 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 81.7 m -59.6 -41.43 90.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.606 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.12 -45.71 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.409 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.68 -45.4 89.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.313 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.3 mt -58.28 -42.51 86.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.509 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -58.8 -45.78 89.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.5 ttp -57.16 -44.33 83.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.503 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -59.09 -46.97 86.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.445 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.47 -43.04 88.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.444 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.9 mt -56.8 -43.87 81.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.498 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -45.73 90.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.15 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -56.04 -42.97 77.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.214 -176.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 37.2 pt -90.47 14.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -174.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.59 27.1 70.05 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.021 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 . . . . . 0 C--N 1.33 -0.239 0 CA-C-N 117.315 0.558 . . . . 0.0 110.156 175.416 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.817 0.342 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.5 mt -53.35 -52.02 60.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.205 -178.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.06 75.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.795 -174.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -53.57 -54.07 42.7 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.598 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 85.5 mtt180 -63.2 -38.26 90.48 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.844 -177.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -60.85 -39.47 89.25 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.529 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -59.24 -47.74 84.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.852 0.358 . . . . 0.0 110.194 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.81 -44.84 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.577 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.04 -47.55 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.621 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -59.5 -41.39 89.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.079 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.19 -47.63 85.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.085 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -121.62 109.72 15.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.32 178.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -94.65 -11.85 28.5 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.2 p -92.1 15.03 14.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -108.74 94.91 15.25 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 119.262 -0.399 . . . . 0.0 110.282 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -48.88 -36.77 34.9 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.319 1.346 . . . . 0.0 113.03 -175.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -57.19 -54.09 50.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.689 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.34 85.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.59 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.5 mm-40 -59.49 -45.54 91.39 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.758 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.41 -46.69 73.22 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 110.471 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.6 92.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.93 -44.25 94.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.936 0.398 . . . . 0.0 110.858 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -57.4 -45.97 83.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.324 0.583 . . . . 0.0 110.034 -179.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 32.9 mttm -59.16 -44.68 92.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.659 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.3 mt -58.06 -46.39 85.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.312 -178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.7 mt -60.04 -40.64 90.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.973 -175.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.6 mt -65.14 -46.16 82.09 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.692 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.03 -39.44 81.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.755 0.312 . . . . 0.0 111.092 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 63.9 m -86.92 16.97 4.39 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -176.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 62.27 50.27 3.92 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.458 0.646 . . . . 0.0 110.824 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -124.88 49.46 3.25 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.171 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -57.58 -39.37 88.89 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.123 1.215 . . . . 0.0 111.544 -175.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -56.03 -37.64 69.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.047 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.98 79.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 0.0 110.12 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.35 -41.88 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.23 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.12 -53.2 43.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.498 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.67 -38.35 66.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 111.234 -176.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -72.99 -53.2 11.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.605 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -57.47 -30.77 65.34 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.791 -175.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -76.93 -12.79 60.0 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -84.36 107.41 10.89 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.661 -0.685 . . . . 0.0 110.294 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.13 -15.71 24.32 Favored 'Trans proline' 0 N--CA 1.502 1.978 0 C-N-CA 121.229 1.286 . . . . 0.0 113.549 -174.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -22.82 77.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 121.262 -0.494 . . . . 0.0 112.873 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -99.3 140.33 18.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 117.608 0.704 . . . . 0.0 110.36 -176.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.07 156.13 22.26 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.584 0.707 . . . . 0.0 111.79 -176.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.6 p -141.63 137.87 32.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.413 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.1 p -124.57 163.45 36.63 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.419 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -46.08 17.37 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 121.453 1.435 . . . . 0.0 112.307 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.18 -42.84 86.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.25 -42.44 95.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.56 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -57.99 -44.32 87.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.029 0.442 . . . . 0.0 110.456 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -59.04 -46.19 88.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.191 0.519 . . . . 0.0 110.179 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.8 mt -57.7 -42.17 83.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -59.25 -46.62 88.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.429 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.4 ttp -57.39 -44.04 84.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.526 -178.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.43 -46.81 87.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.494 -178.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.97 89.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.067 0.461 . . . . 0.0 110.465 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.4 -43.74 79.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.61 -45.85 90.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.209 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -56.14 -41.52 75.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.256 -177.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.4 pt -88.51 14.19 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -175.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.53 22.2 79.1 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 121.373 -0.442 . . . . 0.0 113.206 174.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 117.58 0.69 . . . . 0.0 110.189 176.591 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.8 mtp . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.8 mt -56.39 -47.85 78.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.818 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.4 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.297 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.48 -53.06 56.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.891 0.377 . . . . 0.0 111.329 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -56.35 -44.47 80.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.076 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.56 -40.43 91.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.644 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -58.16 -44.4 87.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.383 . . . . 0.0 110.435 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.64 -47.53 85.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.439 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.29 -46.04 89.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.658 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -59.05 -42.58 90.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.88 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.25 -46.81 87.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.091 0.472 . . . . 0.0 110.07 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -124.42 108.67 12.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.262 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.6 mt -94.84 -11.85 28.07 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.9 15.01 13.97 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 16.7 t -108.83 94.92 15.47 Favored Pre-proline 0 CA--C 1.533 0.314 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.283 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -48.93 -34.96 30.34 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.344 1.362 . . . . 0.0 112.889 -175.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -57.68 -54.86 42.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.908 0.385 . . . . 0.0 110.672 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.95 84.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.557 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.0 mm-40 -59.42 -45.3 91.92 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.812 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.93 -47.46 74.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.911 0.386 . . . . 0.0 110.388 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.39 92.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.338 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -58.92 -44.9 91.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -57.72 -46.47 84.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.338 0.589 . . . . 0.0 110.188 -178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.619 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.6 mt -58.39 -44.31 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.496 -178.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.7 mt -61.48 -41.21 96.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.03 -176.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 20.1 mt -64.17 -46.16 85.22 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -59.08 -40.66 85.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.107 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.2 m -84.82 16.12 3.52 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 61.76 51.14 3.99 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.547 0.689 . . . . 0.0 110.676 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.83 49.36 3.15 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.302 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -56.63 -39.85 88.47 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.144 1.23 . . . . 0.0 111.588 -175.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -55.71 -38.22 69.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.065 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.26 -42.66 79.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.031 0.443 . . . . 0.0 110.094 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.39 -42.84 69.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.158 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.13 -52.09 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.578 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -54.57 -38.23 66.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.923 0.392 . . . . 0.0 111.259 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.2 ttt85 -72.57 -53.84 10.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.576 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -56.72 -31.28 64.36 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.59 59.99 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.6 m -83.7 107.54 10.58 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.214 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -57.78 -16.26 24.63 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 121.266 1.311 . . . . 0.0 113.573 -174.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.62 77.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.972 -177.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.0 mt -99.62 139.76 20.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 117.524 0.662 . . . . 0.0 110.34 -176.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.72 156.06 17.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.673 0.749 . . . . 0.0 111.635 -177.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.7 p -149.14 137.88 21.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.399 176.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 p -124.9 165.03 27.74 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.442 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -45.97 -44.77 18.45 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.472 1.448 . . . . 0.0 112.48 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -58.07 -44.47 87.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.987 0.422 . . . . 0.0 110.289 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.5 m -59.11 -41.41 88.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 24.3 mtp -57.71 -43.57 85.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.456 -178.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.71 -46.26 87.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.121 0.486 . . . . 0.0 110.169 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.5 mt -58.54 -41.9 86.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -58.75 -45.67 89.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.174 0.511 . . . . 0.0 110.358 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 59.7 ttp -58.62 -44.25 89.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.586 -179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.59 -45.74 88.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.47 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.4 91.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.345 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.6 mt -56.33 -42.9 78.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.689 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.14 -46.85 87.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.214 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 22.0 mtp85 -56.12 -41.84 75.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.236 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.5 pt -88.39 13.95 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 70.24 24.18 76.81 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.398 -0.429 . . . . 0.0 113.056 174.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 117.47 0.635 . . . . 0.0 110.287 176.38 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 73.3 mtm . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.891 0.377 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.7 mt -56.43 -47.0 79.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.8 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.0 79.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.237 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.37 -53.24 53.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.907 0.384 . . . . 0.0 111.404 -178.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 83.1 mmt-85 -56.57 -44.09 80.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.055 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -60.43 -40.63 91.76 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.581 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.94 -43.96 86.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.97 0.414 . . . . 0.0 110.439 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -60.77 -47.91 84.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.478 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.12 -45.7 90.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.636 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -59.04 -42.88 91.3 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.819 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -59.29 -46.51 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.076 0.465 . . . . 0.0 109.991 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -125.68 109.08 12.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.386 177.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -95.27 -11.9 27.13 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -91.33 14.86 13.34 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.2 t -108.78 94.79 15.08 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-O 119.273 -0.394 . . . . 0.0 110.244 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.8 -34.75 28.89 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.302 1.335 . . . . 0.0 113.037 -175.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -57.71 -55.15 38.61 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.665 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.34 83.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.495 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.9 mm-40 -59.64 -46.09 90.04 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.668 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.75 -46.82 74.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.95 0.405 . . . . 0.0 110.434 -176.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.52 -44.47 93.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.278 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.85 -44.95 91.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -57.85 -46.62 84.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.267 0.556 . . . . 0.0 110.045 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -58.63 -45.44 89.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.43 -44.97 89.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.553 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.15 -40.62 94.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.884 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.3 mt -64.34 -46.09 85.01 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.619 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -58.69 -40.93 85.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.015 -177.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.61 16.1 3.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 62.0 50.58 4.04 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.431 0.634 . . . . 0.0 110.78 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.85 49.4 3.19 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.167 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -57.61 -38.55 93.17 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.091 1.194 . . . . 0.0 111.688 -174.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.09 -38.19 70.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.0 -42.5 80.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.017 0.437 . . . . 0.0 110.081 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.0 t -55.53 -42.81 69.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.204 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.92 -52.34 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.54 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.6 67.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 111.157 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.2 -53.19 13.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.55 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -56.55 -32.5 65.2 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.656 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -76.85 -11.34 59.81 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -85.01 107.34 11.35 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-O 118.753 -0.641 . . . . 0.0 110.253 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.79 -15.64 22.19 Favored 'Trans proline' 0 N--CA 1.502 1.998 0 C-N-CA 121.26 1.307 . . . . 0.0 113.499 -174.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.85 -22.6 77.01 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.972 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.7 mt -99.99 140.29 19.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.515 0.657 . . . . 0.0 110.339 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.7 156.1 17.61 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.593 0.711 . . . . 0.0 111.722 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.81 137.88 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.465 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 95.8 p -125.98 163.35 40.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.391 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.02 -45.37 17.78 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.446 1.43 . . . . 0.0 112.422 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -58.26 -43.2 87.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.962 0.41 . . . . 0.0 110.369 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.4 m -59.98 -41.87 92.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.3 mtp -57.91 -44.8 87.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.964 0.411 . . . . 0.0 110.403 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.81 -45.75 89.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.303 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.5 mt -58.62 -40.91 84.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.615 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -59.46 -47.41 85.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.106 0.479 . . . . 0.0 110.495 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.1 ttp -57.65 -44.54 85.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.459 -178.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.26 -45.88 90.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.459 -177.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.95 -43.82 91.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.137 0.494 . . . . 0.0 110.496 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.58 -43.29 79.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.535 -178.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.83 -46.07 90.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.308 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -56.39 -40.81 75.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.225 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 39.6 pt -87.53 13.99 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.65 17.64 80.04 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 121.326 -0.464 . . . . 0.0 113.429 174.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt-85 . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 117.704 0.752 . . . . 0.0 110.097 176.952 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.9 mtp . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.014 0.435 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.0 mt -56.36 -44.55 80.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.739 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.2 m -53.48 -53.63 48.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.856 0.36 . . . . 0.0 111.306 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -56.47 -44.13 80.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.021 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -60.6 -40.56 92.23 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.657 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -57.94 -44.14 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.408 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.89 -48.0 83.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.568 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.75 90.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.686 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -60.27 -44.05 95.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.919 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -58.9 -45.23 90.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.059 0.457 . . . . 0.0 110.127 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -126.41 107.69 10.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.324 177.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.5 mt -95.03 -11.94 27.5 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.2 p -91.68 15.06 13.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -107.85 94.87 13.3 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 119.284 -0.388 . . . . 0.0 110.151 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -48.85 -34.43 28.26 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.413 1.408 . . . . 0.0 113.056 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -58.24 -55.21 37.98 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.587 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.41 82.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.609 -179.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -59.71 -46.36 89.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.756 -179.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.69 -46.79 74.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.921 0.391 . . . . 0.0 110.486 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.32 -45.21 91.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.263 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -59.13 -43.95 91.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.897 -178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -57.58 -46.23 84.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 110.15 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -59.05 -44.85 91.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.678 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.54 -45.28 89.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.528 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.9 mt -60.44 -41.11 93.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.3 mt -64.05 -46.15 85.64 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.666 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -58.85 -40.34 83.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.756 0.313 . . . . 0.0 111.147 -177.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.4 m -84.49 15.61 3.62 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 62.14 50.53 3.93 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.463 0.649 . . . . 0.0 110.727 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.93 49.44 3.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.228 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -57.15 -39.67 88.88 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.135 1.224 . . . . 0.0 111.673 -175.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -55.46 -38.03 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.995 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.46 -42.42 78.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.943 0.402 . . . . 0.0 110.135 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.2 t -55.37 -42.25 66.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.25 -52.45 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.552 -177.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.74 -38.62 67.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 0.0 111.204 -176.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.1 ttt85 -72.21 -53.31 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.531 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -56.58 -31.6 64.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 -176.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -76.89 -12.62 59.98 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.4 m -84.66 107.44 11.33 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.149 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.91 -14.83 19.62 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 C-N-CA 121.232 1.288 . . . . 0.0 113.581 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -23.03 77.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 121.196 -0.526 . . . . 0.0 112.906 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -99.85 140.16 19.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 117.446 0.623 . . . . 0.0 110.235 -176.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.36 156.1 19.81 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.507 0.67 . . . . 0.0 111.65 -177.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.4 p -144.19 137.93 27.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.404 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.11 165.12 29.36 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.477 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -45.94 -44.31 18.85 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.442 1.428 . . . . 0.0 112.474 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -58.43 -44.86 89.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.962 0.41 . . . . 0.0 110.258 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.2 m -59.1 -41.62 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.458 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.77 -45.74 85.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.956 0.408 . . . . 0.0 110.39 -178.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -58.83 -45.67 89.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.216 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 38.1 mt -58.77 -41.06 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.68 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -59.53 -47.33 85.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.129 0.49 . . . . 0.0 110.456 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.6 ttp -57.53 -44.14 84.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.451 -178.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -59.3 -46.38 88.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.565 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.121 0.486 . . . . 0.0 110.415 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 93.8 mt -56.48 -43.25 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.642 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.91 -46.27 89.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.379 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -56.41 -40.47 74.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.241 -177.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.0 pt -87.49 13.98 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 113.456 0.909 . . . . 0.0 113.456 -175.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 78.61 15.26 81.1 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 121.322 -0.466 . . . . 0.0 113.506 174.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 117.777 0.789 . . . . 0.0 110.144 177.34 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.1 mtp . . . . . 0 C--O 1.233 0.191 0 CA-C-O 120.933 0.397 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.6 mt -56.59 -44.4 81.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.759 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.04 79.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.334 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.31 -53.25 53.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.998 0.428 . . . . 0.0 111.346 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -56.86 -45.6 82.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.926 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -59.88 -39.28 84.76 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.761 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -58.06 -45.14 87.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.91 0.386 . . . . 0.0 110.336 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -60.29 -48.07 83.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.362 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.03 -45.87 89.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.603 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -59.32 -42.25 90.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -59.02 -46.33 88.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.022 0.439 . . . . 0.0 110.073 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -127.07 110.91 13.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.495 177.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 96.5 mt -94.13 -11.87 29.6 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 178.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.29 15.08 12.73 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.9 t -108.13 94.79 13.72 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.332 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.93 -39.09 39.85 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.381 1.387 . . . . 0.0 113.14 -175.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -56.81 -51.71 67.91 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.825 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.38 -42.99 92.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.568 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -59.3 -45.19 91.97 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.76 -179.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.22 -47.21 72.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.978 0.418 . . . . 0.0 110.454 -176.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.46 -44.93 92.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.21 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -58.76 -44.51 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 0.0 110.839 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -57.65 -46.8 83.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.277 0.561 . . . . 0.0 110.041 -178.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -58.56 -46.04 87.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.697 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.31 -44.22 88.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.571 -178.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.3 mt -60.79 -41.28 95.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.866 -176.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.4 mt -64.47 -46.17 84.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.742 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -59.17 -39.82 83.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.056 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 73.6 m -84.76 15.4 3.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 62.46 50.1 3.81 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.499 0.666 . . . . 0.0 110.869 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -124.88 48.91 2.82 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.421 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.86 -38.27 93.17 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.147 1.231 . . . . 0.0 111.643 -175.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -56.22 -38.21 70.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.01 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.06 -42.12 80.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.044 0.45 . . . . 0.0 110.109 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.62 -43.25 72.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.145 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 45.8 t -65.95 -52.21 51.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.6 -177.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -55.02 -39.06 68.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.831 0.348 . . . . 0.0 111.092 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -72.36 -51.95 18.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.547 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -57.0 -31.62 65.28 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -76.89 -10.06 59.11 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 12.7 m -86.26 106.87 11.22 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.211 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -57.64 -15.0 18.85 Favored 'Trans proline' 0 N--CA 1.5 1.898 0 C-N-CA 121.311 1.341 . . . . 0.0 113.571 -174.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -23.25 77.11 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 121.286 -0.483 . . . . 0.0 112.872 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -98.64 139.77 19.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 117.542 0.671 . . . . 0.0 110.385 -176.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.14 156.1 19.04 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.665 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -144.6 137.84 27.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.515 176.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.86 164.97 29.86 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.414 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -45.81 -43.35 19.29 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 121.454 1.436 . . . . 0.0 112.488 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -59.88 -43.93 94.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.098 178.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.1 m -59.65 -41.46 90.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.572 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.3 mtp -58.13 -45.47 87.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.979 0.419 . . . . 0.0 110.342 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.51 -45.29 89.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.204 0.526 . . . . 0.0 110.231 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 38.7 mt -59.28 -41.22 88.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.611 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -58.08 -45.2 87.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.07 0.462 . . . . 0.0 110.218 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 16.5 ttm -57.74 -45.91 85.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -57.81 -45.26 86.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.513 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.75 91.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.969 0.414 . . . . 0.0 110.306 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 95.1 mt -56.59 -43.34 80.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.037 0.446 . . . . 0.0 110.532 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.5 -44.39 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.391 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 18.0 mtp180 -56.42 -42.67 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 37.8 pt -88.49 14.15 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -174.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.9 23.34 69.57 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.276 -0.487 . . . . 0.0 113.305 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 117.448 0.624 . . . . 0.0 110.172 175.991 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.836 0.35 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.6 mt -56.18 -49.65 73.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.824 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.0 -49.05 79.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.249 -176.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.4 m -53.4 -53.02 57.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.393 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -56.37 -44.3 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.992 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.04 -41.73 92.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.609 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -58.31 -44.03 88.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.79 0.329 . . . . 0.0 110.437 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.16 -47.12 87.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.547 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.52 -46.22 89.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.593 -179.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -59.7 -41.91 91.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -59.5 -46.88 87.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.134 0.492 . . . . 0.0 109.977 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -123.54 106.3 10.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.197 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -93.44 -12.0 30.81 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.26 15.0 14.66 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.6 t -108.03 94.84 13.6 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.351 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -48.75 -34.79 28.69 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.432 1.421 . . . . 0.0 113.155 -174.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.59 -54.91 41.77 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.621 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.1 83.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.53 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -59.77 -46.84 87.93 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.694 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.79 -46.84 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.925 0.393 . . . . 0.0 110.518 -176.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.27 -44.68 92.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.65 -44.22 93.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.922 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -57.65 -46.23 84.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.321 0.582 . . . . 0.0 110.117 -178.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -59.3 -45.14 92.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.679 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.7 mt -59.05 -44.75 91.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.6 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.0 mt -61.11 -41.11 96.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.912 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.17 -46.05 85.71 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.634 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.15 -40.57 85.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.713 0.292 . . . . 0.0 110.931 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.9 m -84.36 16.31 3.15 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 61.78 50.62 4.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.477 0.656 . . . . 0.0 110.842 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.86 48.58 2.64 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.58 -39.46 88.13 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 121.109 1.206 . . . . 0.0 111.773 -174.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -55.55 -38.21 68.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.04 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.37 -42.86 78.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.019 0.438 . . . . 0.0 109.992 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.3 t -55.3 -42.63 67.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.307 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.7 t -67.05 -53.62 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.716 -176.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 21.6 t -54.83 -39.37 68.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.973 0.416 . . . . 0.0 111.153 -176.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.6 ttt-85 -72.98 -50.47 23.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.692 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.6 -32.84 65.65 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.584 -177.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -76.93 -7.55 55.76 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -177.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 39.2 m -86.67 106.73 11.31 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.105 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_exo -57.42 -13.96 14.8 Favored 'Trans proline' 0 N--CA 1.502 2.002 0 C-N-CA 121.234 1.289 . . . . 0.0 113.667 -174.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -24.13 76.58 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.252 -0.499 . . . . 0.0 112.857 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.2 mt -98.01 142.04 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 117.386 0.593 . . . . 0.0 110.397 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.27 156.21 26.21 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.554 -177.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.1 p -146.19 137.86 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.543 176.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -123.56 165.09 24.64 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.365 177.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.91 -44.97 18.02 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.439 1.426 . . . . 0.0 112.509 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.44 -43.31 88.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.318 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.0 m -60.11 -42.86 95.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.865 0.364 . . . . 0.0 110.589 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -57.97 -43.4 86.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.441 -178.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -59.04 -46.45 88.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.146 0.498 . . . . 0.0 110.083 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 35.6 mt -58.52 -41.0 84.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.647 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 38.7 t80 -58.81 -45.35 90.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.084 0.469 . . . . 0.0 110.387 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 15.1 ttm -57.92 -45.82 85.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.407 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -57.84 -45.49 86.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.521 -176.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.15 -45.73 92.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.979 0.419 . . . . 0.0 110.402 -178.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.65 -42.68 79.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.005 0.431 . . . . 0.0 110.629 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -60.99 -45.37 95.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.408 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.3 mtp180 -56.63 -41.36 77.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.114 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -87.44 13.99 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.89 21.36 79.84 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.428 -0.415 . . . . 0.0 113.265 173.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 117.626 0.713 . . . . 0.0 110.146 176.569 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.921 0.391 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.2 mt -56.49 -47.65 78.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.745 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -48.98 79.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.121 -177.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.03 -53.2 53.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.892 0.377 . . . . 0.0 111.474 -178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 82.7 mmt-85 -56.28 -44.51 79.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.954 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -60.34 -39.93 88.87 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.68 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.99 -44.14 87.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.976 0.417 . . . . 0.0 110.389 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -60.88 -47.43 86.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.526 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.36 -45.39 91.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.664 -179.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.32 -42.83 92.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.905 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -59.51 -47.08 86.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.087 0.47 . . . . 0.0 109.982 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.4 108.81 12.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.302 177.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.9 mt -95.92 -11.92 25.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.33 14.76 13.62 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.0 t -108.53 94.78 14.55 Favored Pre-proline 0 CA--C 1.533 0.294 0 O-C-N 122.042 -0.411 . . . . 0.0 110.183 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.86 -34.37 28.12 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.431 1.421 . . . . 0.0 112.894 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.13 -55.33 36.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.816 0.341 . . . . 0.0 110.679 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.02 81.62 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.569 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -59.85 -46.46 89.22 Favored 'General case' 0 N--CA 1.461 0.12 0 C-N-CA 120.382 -0.527 . . . . 0.0 109.672 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.47 74.09 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.936 0.398 . . . . 0.0 110.506 -176.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.99 92.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.247 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -58.72 -45.01 90.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 110.869 -179.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -57.64 -46.55 84.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.371 0.605 . . . . 0.0 110.104 -178.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.5 mttt -58.82 -45.59 89.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.757 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.8 mt -58.47 -44.47 89.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.522 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.16 -41.13 96.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.959 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 13.8 mt -64.1 -46.07 85.85 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.492 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.53 -41.44 85.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.738 0.304 . . . . 0.0 111.0 -177.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.52 16.11 3.35 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 61.88 51.18 3.87 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.474 0.654 . . . . 0.0 110.695 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -124.91 49.77 3.53 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.116 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -56.42 -39.87 88.39 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 121.183 1.256 . . . . 0.0 111.575 -175.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.57 -38.1 68.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.114 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.32 -42.4 79.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.07 0.462 . . . . 0.0 110.117 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.75 -42.47 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.185 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.0 t -66.23 -52.19 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -177.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -54.54 -38.15 66.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.0 111.23 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.7 ttt85 -72.89 -53.94 10.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.499 -178.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -56.64 -31.21 64.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.35 60.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -84.67 107.06 9.98 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.207 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -58.16 -15.22 22.31 Favored 'Trans proline' 0 N--CA 1.501 1.912 0 C-N-CA 121.31 1.34 . . . . 0.0 113.571 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -23.55 76.99 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 121.305 -0.474 . . . . 0.0 112.856 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.9 mt -98.15 139.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 117.529 0.664 . . . . 0.0 110.362 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.32 156.05 16.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.693 0.759 . . . . 0.0 111.594 -176.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -143.33 137.95 29.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.348 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.5 p -125.35 163.48 38.07 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.304 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -45.96 -45.11 17.97 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 121.378 1.385 . . . . 0.0 112.476 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -58.36 -43.97 88.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.317 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.81 -41.5 91.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -57.91 -44.94 87.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.954 0.407 . . . . 0.0 110.442 -178.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.95 -46.22 88.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.248 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.6 mt -58.26 -40.83 82.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.678 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -59.37 -47.62 84.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.415 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.2 ttp -57.43 -42.93 83.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -59.22 -47.38 85.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.543 -178.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.77 -43.45 90.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.019 0.437 . . . . 0.0 110.364 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.7 mt -56.68 -43.77 80.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.588 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.3 -46.04 89.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.151 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.4 mtp85 -56.42 -42.19 77.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.284 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 38.3 pt -89.47 14.16 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -174.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.65 25.59 69.56 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.309 -0.472 . . . . 0.0 113.154 173.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 117.448 0.624 . . . . 0.0 110.109 175.564 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 95.0 mmm . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.908 0.385 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.9 mt -56.09 -45.86 79.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.831 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.04 78.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.367 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.19 -52.86 57.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.971 0.415 . . . . 0.0 111.344 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -56.86 -46.14 81.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.014 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.99 -39.01 84.27 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.752 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -57.89 -45.2 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.48 -47.12 87.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.481 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.52 89.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.628 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.46 -42.2 91.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -58.85 -45.5 89.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.126 0.489 . . . . 0.0 110.098 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -126.22 104.85 8.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.117 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 97.1 mt -90.6 -11.86 38.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.75 15.05 15.45 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 2.9 t -107.41 94.88 12.37 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.251 -0.404 . . . . 0.0 110.376 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -48.8 -39.2 38.91 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.447 1.431 . . . . 0.0 113.37 -174.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -57.33 -49.57 75.71 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.78 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.13 98.5 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.39 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -59.06 -45.82 89.82 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.61 -47.31 73.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.422 -176.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.49 91.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.311 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -59.66 -44.29 93.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 110.931 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -57.58 -46.41 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.352 0.596 . . . . 0.0 110.111 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -58.98 -45.22 91.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.709 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.9 mt -58.35 -44.92 88.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.575 -178.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -60.79 -41.65 96.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.926 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.2 mt -63.74 -46.13 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.621 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -58.6 -41.06 84.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.986 -177.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.3 m -84.42 15.67 3.54 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 61.98 50.76 3.97 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.481 0.658 . . . . 0.0 110.769 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.323 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -39.36 91.91 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 121.15 1.233 . . . . 0.0 111.687 -175.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.93 -37.98 69.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.959 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.13 -41.97 80.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.03 0.443 . . . . 0.0 110.129 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.6 t -55.22 -43.23 69.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.153 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.41 -52.17 54.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.61 67.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 0.0 111.172 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.1 ttt85 -72.19 -53.45 12.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.604 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -56.74 -31.56 64.67 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.756 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -76.84 -13.11 60.04 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 32.9 m -83.36 107.63 10.49 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.194 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.69 -15.8 22.33 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 121.215 1.277 . . . . 0.0 113.543 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.76 77.24 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.883 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 75.2 mt -99.88 141.59 16.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 117.615 0.707 . . . . 0.0 110.34 -176.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.15 156.13 26.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.753 -176.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.5 p -141.71 137.79 31.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.478 176.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 90.1 p -123.9 163.44 35.3 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.365 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -45.99 -46.0 16.66 Favored 'Trans proline' 0 N--CA 1.498 1.775 0 C-N-CA 121.424 1.416 . . . . 0.0 112.442 178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -58.15 -43.06 87.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.363 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.3 m -60.08 -42.12 93.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.885 0.374 . . . . 0.0 110.601 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -58.02 -44.64 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.332 -178.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.85 -45.97 88.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.151 0.5 . . . . 0.0 110.252 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 36.4 mt -58.84 -41.46 86.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.585 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -58.62 -46.29 87.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.128 0.49 . . . . 0.0 110.351 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.0 ttp -57.6 -45.18 85.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.41 -45.64 87.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.45 92.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.461 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.69 -43.33 80.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.581 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.75 -46.53 88.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.278 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -56.62 -40.36 75.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.187 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 42.3 pt -88.4 14.0 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.05 14.67 82.38 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 121.415 -0.421 . . . . 0.0 113.592 173.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 61.7 mtt85 . . . . . 0 C--N 1.333 -0.151 0 CA-C-N 117.831 0.816 . . . . 0.0 110.334 177.532 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.5 mtp . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.921 0.391 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.0 mt -56.54 -44.87 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.796 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -49.08 78.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.407 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.3 m -54.01 -53.02 58.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 0.0 111.244 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.2 mmt-85 -56.73 -44.38 81.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.005 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -60.55 -40.35 91.25 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.693 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -58.3 -43.95 88.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 110.373 -178.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -60.76 -47.71 85.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.56 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.35 88.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.642 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.96 -42.0 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.861 -178.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.9 ttmp? -59.65 -46.93 87.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.063 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -124.93 109.98 13.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.451 178.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.8 -11.91 26.14 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 178.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.41 14.99 13.14 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.57 94.85 17.43 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.248 178.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -49.0 -34.69 29.98 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.341 1.361 . . . . 0.0 112.867 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -57.55 -55.38 35.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.84 0.352 . . . . 0.0 110.701 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.09 81.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.577 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.5 mm-40 -59.75 -46.37 89.37 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.684 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.65 -46.77 74.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.918 0.389 . . . . 0.0 110.519 -176.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.22 -44.61 92.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.261 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -59.25 -44.71 92.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.978 0.418 . . . . 0.0 110.808 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -57.66 -46.68 83.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.286 0.565 . . . . 0.0 110.141 -178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 34.9 mttp -58.45 -46.73 85.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.54 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.18 -44.01 87.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.603 -177.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.2 -41.3 96.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.988 -177.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.29 -46.11 85.08 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.645 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -59.39 -40.15 85.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.094 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.8 m -84.17 15.0 3.75 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 -176.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 62.6 50.52 3.49 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.475 0.655 . . . . 0.0 110.76 177.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -124.93 49.6 3.4 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.177 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.46 -40.53 83.98 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.17 1.247 . . . . 0.0 111.541 -175.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.13 -38.1 67.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.11 -179.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -68.28 -42.29 79.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.015 0.435 . . . . 0.0 110.021 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.61 -42.98 71.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.177 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 49.9 t -65.4 -51.92 58.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.572 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.5 t -54.73 -38.91 67.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.377 . . . . 0.0 111.258 -176.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -72.13 -53.07 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.539 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.69 -31.59 64.6 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -76.83 -14.52 59.9 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -81.83 107.81 9.42 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.789 -0.624 . . . . 0.0 110.232 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -57.98 -17.14 29.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 121.235 1.29 . . . . 0.0 113.51 -174.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.35 77.07 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.323 -0.465 . . . . 0.0 113.0 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.47 139.83 20.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 117.557 0.679 . . . . 0.0 110.389 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.31 156.05 16.51 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.633 0.73 . . . . 0.0 111.712 -176.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -144.21 137.83 27.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.457 176.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.3 p -126.0 163.49 39.27 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.42 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -46.04 -45.31 17.95 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.428 1.419 . . . . 0.0 112.477 178.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.23 -43.83 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.34 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.2 m -59.22 -41.61 89.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.498 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.02 -44.94 87.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.003 0.43 . . . . 0.0 110.445 -178.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.6 -45.42 89.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.164 0.507 . . . . 0.0 110.308 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.7 mt -59.22 -42.21 90.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.477 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -58.05 -45.12 87.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.201 0.524 . . . . 0.0 110.327 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.99 -46.08 85.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.393 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.24 -45.21 88.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.508 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.54 92.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.075 0.464 . . . . 0.0 110.37 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 94.1 mt -56.17 -42.72 77.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.605 -178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -59.83 -46.35 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.262 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -55.88 -41.57 74.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.156 -177.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.4 pt -88.77 14.06 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -174.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.35 20.57 79.92 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 121.38 -0.438 . . . . 0.0 113.31 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 117.637 0.719 . . . . 0.0 110.258 176.712 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.6 ttm . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.913 0.387 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.8 mt -55.8 -48.57 75.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.855 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -49.02 79.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -176.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.15 -53.24 53.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.009 0.433 . . . . 0.0 111.439 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -56.91 -44.52 82.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.978 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.53 -40.43 87.15 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.507 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -58.32 -45.09 88.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.873 0.368 . . . . 0.0 110.33 -178.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.36 -47.27 86.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.504 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.3 -44.59 92.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.69 -179.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -59.61 -43.2 93.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.863 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -59.3 -46.84 87.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.026 0.441 . . . . 0.0 110.029 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -124.06 108.76 12.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.386 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.43 -11.86 26.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.9 p -92.33 14.99 14.82 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 26.2 t -108.4 94.84 14.39 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 122.033 -0.417 . . . . 0.0 110.326 178.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -48.87 -34.89 29.77 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 121.345 1.363 . . . . 0.0 113.028 -175.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.94 -55.05 39.93 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.653 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.91 84.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.561 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -59.8 -45.52 92.08 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.678 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.57 75.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.969 0.414 . . . . 0.0 110.432 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.38 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.322 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.99 -44.9 91.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.788 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -57.8 -47.46 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -57.97 -46.27 85.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.0 mt -58.58 -44.32 89.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.562 -177.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.34 -40.82 92.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.876 -177.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.86 -46.03 83.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.796 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.85 -39.74 82.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.974 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.3 m -85.33 15.15 4.56 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 62.48 50.43 3.65 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 121.459 0.647 . . . . 0.0 110.848 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.395 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -56.14 -39.18 92.87 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.305 1.337 . . . . 0.0 111.523 -176.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.63 -38.26 69.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.06 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -67.97 -42.83 80.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.019 0.438 . . . . 0.0 110.024 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.37 -42.09 65.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 55.7 t -65.84 -53.1 41.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.536 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 25.4 m -54.46 -38.04 65.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 111.24 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -72.98 -54.03 9.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.604 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -57.3 -30.3 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.784 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -76.96 -13.99 59.9 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.9 m -84.85 107.12 10.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.78 -0.628 . . . . 0.0 110.325 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -58.39 -15.18 23.28 Favored 'Trans proline' 0 N--CA 1.502 1.973 0 C-N-CA 121.219 1.28 . . . . 0.0 113.612 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.03 77.25 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.896 -177.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.4 mt -98.65 140.18 18.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 117.49 0.645 . . . . 0.0 110.355 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.64 156.14 20.72 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.544 0.688 . . . . 0.0 111.701 -176.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.0 p -147.15 137.93 23.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.33 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -123.77 165.07 25.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.422 178.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.87 -43.96 18.92 Favored 'Trans proline' 0 N--CA 1.498 1.768 0 C-N-CA 121.434 1.423 . . . . 0.0 112.516 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.81 -45.94 88.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.257 177.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 72.1 m -58.0 -40.91 81.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.959 0.409 . . . . 0.0 110.513 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.52 -45.96 87.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.986 0.422 . . . . 0.0 110.456 -177.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -58.57 -44.37 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.255 0.55 . . . . 0.0 110.171 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.86 -42.15 83.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.54 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -58.97 -46.95 86.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.344 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.27 -43.2 82.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.448 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -59.32 -49.64 77.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.317 -178.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.21 -40.93 82.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.443 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.4 mt -56.93 -43.8 81.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.916 0.389 . . . . 0.0 110.444 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.64 -44.6 93.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.198 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 53.7 mtt-85 -55.58 -42.87 75.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.196 -176.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 26.1 pt -90.1 14.08 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.82 26.25 69.74 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 121.272 -0.49 . . . . 0.0 112.985 174.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 117.315 0.557 . . . . 0.0 109.952 175.3 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.672 0.273 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.7 mt -53.88 -52.19 61.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.036 0.446 . . . . 0.0 111.077 -178.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.33 -48.98 75.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.58 -175.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.2 m -53.08 -54.05 41.32 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.703 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 81.5 mtt-85 -63.57 -37.74 88.45 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.846 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -60.51 -39.93 89.59 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.485 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -59.06 -46.5 88.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.871 0.367 . . . . 0.0 110.182 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.08 -45.7 92.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.519 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.76 -46.01 90.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.676 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -58.93 -43.1 91.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.898 -177.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.63 -47.2 87.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.941 0.4 . . . . 0.0 110.115 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -120.02 105.58 11.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.316 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -92.29 -12.01 33.64 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.96 15.04 14.02 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.7 t -107.75 94.66 12.69 Favored Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 118.046 0.385 . . . . 0.0 110.296 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.89 -39.68 39.72 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.44 1.427 . . . . 0.0 113.162 -175.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -56.52 -51.31 69.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.826 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.57 -42.78 93.25 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.511 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -59.1 -45.39 90.99 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.783 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.72 -47.11 74.16 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.934 0.397 . . . . 0.0 110.527 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.1 92.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.278 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -59.83 -44.85 93.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -57.4 -46.41 83.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 110.086 -178.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -58.78 -45.86 88.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.748 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 16.6 mt -58.2 -44.82 88.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 -178.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.6 mt -60.61 -40.68 92.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.932 -176.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.1 mt -64.66 -46.22 83.43 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.684 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.45 -39.48 83.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.071 -177.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.8 m -86.01 16.62 4.06 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 62.36 50.57 3.71 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.495 0.665 . . . . 0.0 110.857 176.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.9 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.21 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -57.23 -40.86 79.34 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.233 1.289 . . . . 0.0 111.629 -174.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.55 -37.79 68.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.037 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.22 -42.78 79.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.078 -178.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.43 -42.89 69.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.122 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.8 t -65.52 -52.19 54.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.572 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 m -54.91 -38.85 68.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.238 -176.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.04 -53.28 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.52 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.74 -32.6 65.72 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.011 -0.276 . . . . 0.0 111.661 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.83 -12.36 59.96 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.399 0.889 . . . . 0.0 113.399 -177.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.0 m -83.72 107.63 10.9 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.146 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -57.66 -16.67 25.56 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.185 1.256 . . . . 0.0 113.489 -174.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.25 76.97 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.962 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -100.21 140.96 18.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.597 0.698 . . . . 0.0 110.342 -176.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.66 156.11 20.83 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.629 0.728 . . . . 0.0 111.741 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.52 137.91 30.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.426 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 93.7 p -124.55 163.31 37.43 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.384 177.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -45.96 -45.01 18.12 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.483 1.455 . . . . 0.0 112.458 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.33 -43.24 88.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.378 177.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 75.8 m -59.75 -41.62 91.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.989 0.423 . . . . 0.0 110.572 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.12 -45.77 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.039 0.447 . . . . 0.0 110.432 -178.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.97 -45.54 90.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.203 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 44.8 mt -58.22 -41.38 83.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -59.36 -47.37 85.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.203 0.525 . . . . 0.0 110.467 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.72 -44.5 86.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.49 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.41 -45.97 90.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.09 -44.09 91.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.947 0.404 . . . . 0.0 110.32 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 95.4 mt -56.4 -43.29 79.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.681 -178.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.68 -46.36 89.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 8.7 mtp-105 -56.88 -40.92 77.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.271 -177.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 39.0 pt -87.57 14.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -175.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.61 20.25 79.79 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 119.859 -0.412 . . . . 0.0 113.331 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 117.734 0.767 . . . . 0.0 110.011 176.699 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.3 ttm . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.931 0.396 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.81 -46.39 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.93 79.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.392 -176.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.4 -52.83 58.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.019 0.438 . . . . 0.0 111.397 -178.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -56.71 -45.66 81.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.059 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -60.25 -39.38 86.57 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.705 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -57.74 -44.36 85.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.337 -178.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -61.04 -48.66 80.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.496 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.57 -42.81 88.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.686 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -59.11 -43.39 91.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 -178.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.4 mttp -58.91 -46.94 86.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.117 0.484 . . . . 0.0 110.076 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -125.93 108.8 11.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.473 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.39 -11.96 26.81 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 177.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.61 14.73 14.23 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.1 t -107.87 94.82 13.23 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.066 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -48.78 -34.77 28.81 Favored 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.396 1.397 . . . . 0.0 113.114 -174.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.76 -55.41 35.18 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.652 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.67 85.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.555 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -59.28 -45.56 90.92 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.772 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.74 -49.19 71.42 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.461 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.75 89.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.37 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -59.28 -44.36 92.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 -179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -56.76 -43.98 81.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.349 0.595 . . . . 0.0 110.178 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -58.19 -48.21 81.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.938 -178.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 44.3 mt -57.0 -43.88 82.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.612 -176.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 22.3 mt -61.22 -41.02 96.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.956 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.0 mt -64.53 -46.05 84.56 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.511 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.72 -40.49 83.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.9 m -85.44 15.98 4.09 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 m120 61.8 51.18 3.94 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.506 0.669 . . . . 0.0 110.718 177.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -124.87 49.88 3.59 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.149 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.44 -39.81 88.8 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.108 1.205 . . . . 0.0 111.58 -175.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.92 -38.15 69.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.994 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -68.18 -42.54 79.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.04 0.448 . . . . 0.0 110.086 -178.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.75 -42.86 71.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.151 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.71 -52.12 54.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.647 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -55.06 -38.69 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.82 0.343 . . . . 0.0 111.115 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.03 -53.01 14.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.495 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.61 -32.51 65.34 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.726 -176.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -76.98 -12.18 59.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -177.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.7 m -84.01 107.87 12.06 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.226 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -57.62 -16.3 23.84 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 121.263 1.309 . . . . 0.0 113.542 -174.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -22.66 77.19 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 121.228 -0.51 . . . . 0.0 112.902 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.5 mt -100.89 140.32 20.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.574 0.687 . . . . 0.0 110.281 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.21 156.16 22.68 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.69 0.757 . . . . 0.0 111.578 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.5 p -143.03 137.81 29.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.411 175.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -126.1 165.09 29.55 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.463 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.88 -44.12 18.8 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 121.486 1.457 . . . . 0.0 112.424 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.6 -45.35 89.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.903 0.382 . . . . 0.0 110.288 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.4 m -58.78 -41.01 85.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.56 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.18 -45.47 87.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.435 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -59.1 -46.36 88.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.5 mt -58.1 -42.25 85.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.519 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.91 -45.99 90.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.659 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.4 ttp -57.72 -45.44 85.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.411 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -58.73 -46.0 88.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.41 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.19 90.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.09 0.472 . . . . 0.0 110.364 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.9 mt -56.58 -44.19 80.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.655 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -58.95 -46.11 88.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.4 mtp180 -56.62 -41.02 76.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.226 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -89.23 14.05 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -175.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.63 19.78 79.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 121.342 -0.456 . . . . 0.0 113.399 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 117.598 0.699 . . . . 0.0 110.192 176.883 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.6 mtp . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.871 0.367 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.1 mt -56.04 -47.34 78.06 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.956 -178.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.18 78.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.386 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.88 -52.43 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 111.243 -178.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -56.76 -45.7 81.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.62 -40.06 86.31 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.556 -178.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.33 -45.66 87.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.882 0.372 . . . . 0.0 110.401 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -60.25 -46.18 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.453 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.67 84.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.659 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.48 -40.51 87.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.939 -177.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.36 -46.8 87.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.052 0.453 . . . . 0.0 109.976 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -125.48 108.08 11.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.3 177.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.9 mt -93.39 -11.81 31.36 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.43 14.96 15.1 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -108.36 94.82 14.26 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 118.057 0.39 . . . . 0.0 110.291 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -48.83 -34.45 28.18 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 121.417 1.411 . . . . 0.0 113.105 -175.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -58.32 -55.2 38.06 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.629 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.78 -41.67 82.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.641 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.4 mm-40 -59.8 -46.38 89.4 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.419 -0.512 . . . . 0.0 109.658 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.66 -45.52 73.87 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.98 0.419 . . . . 0.0 110.531 -175.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.49 92.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.204 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -58.99 -44.26 91.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.001 0.429 . . . . 0.0 110.8 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -57.47 -46.79 83.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 0.0 110.063 -178.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -58.19 -46.65 85.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.521 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.28 -43.76 88.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 -177.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.3 mt -61.45 -41.05 96.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.983 -176.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 19.6 mt -64.92 -46.03 83.35 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.716 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.4 -39.76 84.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.133 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.5 m -85.27 16.32 3.72 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -176.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 62.16 50.66 3.85 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.488 0.661 . . . . 0.0 110.731 176.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -124.89 49.57 3.35 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.375 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.04 -40.43 83.87 Favored 'Trans proline' 0 N--CA 1.497 1.687 0 C-N-CA 121.168 1.245 . . . . 0.0 111.691 -175.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.66 -37.41 68.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.024 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.81 -42.1 77.74 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.974 0.416 . . . . 0.0 110.135 -178.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.13 -41.82 61.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.269 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 62.0 t -65.26 -53.23 42.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.514 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 m -54.45 -38.42 66.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 111.238 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.2 ttt85 -73.08 -53.27 11.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.535 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -57.37 -30.33 64.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.733 -176.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.79 -12.79 60.03 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.4 m -85.66 106.98 10.81 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.69 -0.671 . . . . 0.0 110.241 179.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.43 -14.17 19.58 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.209 1.273 . . . . 0.0 113.613 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.76 76.83 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.772 -177.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -98.37 140.73 17.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 117.53 0.665 . . . . 0.0 110.377 -176.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.08 156.06 22.47 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.619 0.723 . . . . 0.0 111.719 -177.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -144.88 137.86 26.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.505 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.06 165.06 29.66 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.386 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.93 -44.63 18.43 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.476 1.451 . . . . 0.0 112.476 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.34 -44.8 88.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.948 0.404 . . . . 0.0 110.3 177.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 74.9 m -58.79 -42.15 88.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.476 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.1 mtp -58.82 -45.09 90.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.546 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -58.56 -45.48 88.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.206 0.526 . . . . 0.0 110.19 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 35.1 mt -58.16 -43.19 87.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.284 0.564 . . . . 0.0 110.288 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -57.9 -45.31 86.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.362 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -57.72 -45.16 86.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.456 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.63 -46.12 87.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.463 -178.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.64 91.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 93.3 mt -56.36 -43.58 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.581 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -59.71 -46.1 90.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.239 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -56.34 -40.89 75.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.222 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.8 pt -88.28 13.99 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -174.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.58 19.79 78.93 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.382 -0.437 . . . . 0.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 117.645 0.723 . . . . 0.0 110.124 176.675 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.8 mtp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.948 0.404 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.5 mt -55.57 -47.16 76.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.009 -178.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.69 -49.06 79.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.529 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.6 m -54.08 -52.69 60.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.871 0.367 . . . . 0.0 111.265 -178.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 33.6 mmt180 -57.28 -45.16 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.885 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -59.87 -40.2 87.82 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.548 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -58.61 -45.58 88.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.817 0.341 . . . . 0.0 110.308 -178.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.35 -46.18 90.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.536 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.62 -48.05 83.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.5 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.27 -40.77 87.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.95 -177.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.4 tttp -59.29 -46.28 88.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.081 0.467 . . . . 0.0 110.008 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -126.11 108.66 11.55 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.317 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -93.47 -11.94 30.87 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.31 15.01 14.73 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 17.7 t -108.51 94.72 14.39 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.255 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -48.73 -34.95 28.97 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 121.379 1.386 . . . . 0.0 113.067 -175.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.77 -55.06 39.74 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.634 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.65 83.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.638 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -59.47 -45.9 90.32 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.74 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.46 -47.2 73.19 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.127 0.489 . . . . 0.0 110.424 -176.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -45.07 92.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.265 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -58.64 -44.27 90.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.808 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -57.58 -46.75 83.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.272 0.558 . . . . 0.0 110.103 -178.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 29.9 mttp -58.51 -45.93 87.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.683 -178.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.47 -44.37 89.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.529 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.87 -41.28 95.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.994 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.68 -46.14 83.67 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.714 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.94 -40.02 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.071 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 68.1 m -85.75 16.57 3.91 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 61.76 51.06 4.02 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.42 0.628 . . . . 0.0 110.697 176.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -124.86 49.6 3.36 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.272 177.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -56.19 -40.65 83.47 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.225 1.283 . . . . 0.0 111.579 -175.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.46 -38.03 68.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.09 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.63 -41.78 78.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 110.188 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.3 t -55.44 -42.39 67.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.235 179.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 52.6 t -65.96 -52.49 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.7 m -54.63 -38.33 66.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.801 0.334 . . . . 0.0 111.212 -176.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -73.06 -53.35 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.516 -178.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -56.78 -31.58 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.91 -12.91 60.02 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.5 m -84.69 107.45 11.38 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-O 118.73 -0.653 . . . . 0.0 110.24 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.83 -15.83 23.19 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 121.238 1.292 . . . . 0.0 113.554 -174.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.08 -22.16 77.18 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.868 -177.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -100.24 139.44 21.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 117.646 0.723 . . . . 0.0 110.266 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.09 156.07 18.94 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.571 0.701 . . . . 0.0 111.861 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.7 p -144.77 137.89 26.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.394 176.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -126.03 164.99 30.02 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.547 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.86 -44.84 17.94 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.506 1.471 . . . . 0.0 112.533 179.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.29 -44.03 88.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.981 0.419 . . . . 0.0 110.376 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.7 m -59.17 -41.76 89.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.489 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.33 -45.67 87.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.412 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.53 -45.4 88.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.127 0.489 . . . . 0.0 110.238 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 45.0 mt -58.41 -42.67 87.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.347 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -58.12 -45.69 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.124 0.488 . . . . 0.0 110.354 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.06 -44.35 82.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.497 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -58.99 -49.06 79.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.229 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.56 83.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.566 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.81 -43.23 80.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.958 0.408 . . . . 0.0 110.403 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.89 -44.71 94.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.281 177.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -55.48 -43.09 75.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.068 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 31.4 pt -89.24 14.14 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -174.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.93 25.59 68.92 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 121.238 -0.506 . . . . 0.0 113.116 173.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 117.353 0.577 . . . . 0.0 110.05 175.519 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.873 0.368 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.53 -46.48 80.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.3 -49.02 79.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.296 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.67 -53.33 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.357 -178.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -56.72 -43.75 80.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.26 -40.44 90.33 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.61 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -57.99 -43.76 86.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.898 0.38 . . . . 0.0 110.398 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -60.59 -47.81 84.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.482 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.85 90.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.671 -178.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.26 -42.32 90.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.863 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.0 tttp -58.95 -46.02 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.06 0.457 . . . . 0.0 110.036 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -127.68 110.39 12.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.381 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.8 mt -95.3 -11.91 27.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.08 15.01 14.3 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.9 t -108.67 94.87 15.02 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 119.195 -0.431 . . . . 0.0 110.295 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.77 -34.4 27.65 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.402 1.401 . . . . 0.0 113.038 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.79 -55.67 31.89 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.683 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.7 83.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.579 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -59.68 -45.8 90.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.739 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.64 75.08 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.963 0.411 . . . . 0.0 110.481 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.39 -44.55 92.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.285 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.04 -44.87 91.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.025 0.44 . . . . 0.0 110.926 -178.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -57.7 -46.66 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.341 0.591 . . . . 0.0 110.099 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.7 mttp -58.48 -45.96 87.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.4 mt -58.21 -44.38 88.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 -178.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 20.0 mt -60.86 -40.88 94.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.924 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.2 mt -64.42 -46.1 84.69 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.67 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -58.92 -39.93 83.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.746 0.308 . . . . 0.0 111.08 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.7 m -85.05 14.91 4.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -176.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.8 t30 62.53 50.56 3.55 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.499 0.666 . . . . 0.0 110.808 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.204 177.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.96 -39.12 93.77 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 121.159 1.239 . . . . 0.0 111.605 -175.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -55.88 -38.07 69.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.05 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -68.41 -42.18 79.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.938 0.399 . . . . 0.0 110.059 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.5 t -55.77 -42.89 71.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.187 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.9 t -65.83 -51.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.617 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.1 t -54.84 -38.7 67.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.931 0.396 . . . . 0.0 111.183 -176.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -72.42 -53.12 13.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.551 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -56.55 -32.15 64.85 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.683 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.88 -11.91 59.89 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -85.28 107.22 11.24 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.292 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.98 -15.22 21.47 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 121.298 1.332 . . . . 0.0 113.502 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.88 77.28 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 121.279 -0.486 . . . . 0.0 112.858 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.3 mt -99.83 141.14 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.514 0.657 . . . . 0.0 110.282 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.58 156.07 20.65 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.624 0.726 . . . . 0.0 111.689 -176.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -142.8 137.91 30.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.454 176.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 96.7 p -125.97 163.34 40.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.406 177.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.13 -45.22 18.43 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 121.459 1.439 . . . . 0.0 112.454 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.44 -43.48 88.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.251 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.1 m -59.69 -41.36 90.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.562 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.1 -45.16 87.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.999 0.428 . . . . 0.0 110.429 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.81 -45.27 90.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.224 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.7 mt -58.97 -41.77 88.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.562 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -58.8 -45.99 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.184 0.516 . . . . 0.0 110.347 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 64.1 ttp -57.68 -46.01 84.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.39 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.41 -45.23 88.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.503 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.4 -44.49 92.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.436 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 93.4 mt -56.09 -42.31 76.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.694 -178.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -60.24 -46.17 90.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.231 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.3 mtp85 -56.43 -41.39 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.216 -177.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 37.2 pt -88.18 14.02 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -175.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.36 24.67 74.95 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 121.498 -0.382 . . . . 0.0 113.06 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 45.1 mtp85 . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 117.485 0.642 . . . . 0.0 110.056 176.238 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.5 mtp . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.773 0.32 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.7 mt -53.53 -52.11 60.72 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.116 -178.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.46 -49.01 73.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.716 -174.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -54.17 -54.08 44.7 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.583 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 77.8 mtt-85 -63.93 -37.05 85.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.942 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -61.26 -40.14 92.97 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.468 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -59.31 -45.58 90.92 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.19 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -59.95 -45.2 93.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.542 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.32 -47.7 84.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.62 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -58.96 -41.55 87.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.969 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -59.76 -47.16 86.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.073 0.464 . . . . 0.0 110.024 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -125.74 111.12 14.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.366 177.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.7 mt -94.64 -11.99 28.24 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -91.71 15.06 13.52 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.3 t -107.81 94.89 13.23 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.295 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -48.92 -37.22 36.28 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.363 1.375 . . . . 0.0 113.113 -174.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.27 -53.79 54.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 0.0 110.675 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.19 -42.68 86.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.598 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.46 -45.15 92.44 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.77 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -47.08 73.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.937 0.398 . . . . 0.0 110.477 -176.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.02 -44.54 91.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.338 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.71 -43.66 94.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.433 . . . . 0.0 110.863 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -57.64 -46.49 84.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.321 0.581 . . . . 0.0 110.018 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.9 mttt -58.89 -42.95 90.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.758 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 14.1 mt -58.26 -48.15 81.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.0 110.35 -179.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.39 -40.19 85.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 23.9 mt -65.37 -46.13 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.832 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -59.02 -39.14 81.0 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.969 -177.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.1 m -87.61 17.34 4.71 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.2 t30 62.15 50.56 3.91 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.431 0.634 . . . . 0.0 110.883 176.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.86 49.45 3.23 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.544 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.34 -39.69 89.65 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 121.236 1.291 . . . . 0.0 111.707 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.36 -38.46 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.016 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -67.98 -41.97 81.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.412 . . . . 0.0 110.126 -178.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.95 -43.53 75.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.185 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.2 t -65.1 -51.99 58.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.539 -177.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -55.29 -39.41 69.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.945 0.403 . . . . 0.0 111.135 -176.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -71.66 -51.7 21.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.573 -178.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -57.14 -33.06 67.0 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.649 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -76.96 -10.2 59.21 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.6 m -84.2 107.54 11.17 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.708 -0.663 . . . . 0.0 110.223 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.74 -17.39 29.12 Favored 'Trans proline' 0 N--CA 1.501 1.956 0 C-N-CA 121.237 1.291 . . . . 0.0 113.478 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.91 -21.65 76.8 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.01 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.2 mt -101.08 140.3 20.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 117.58 0.69 . . . . 0.0 110.355 -176.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.61 156.11 24.19 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.767 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -142.8 137.85 29.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.381 176.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.5 p -125.96 165.11 29.17 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.457 177.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.96 -44.58 18.63 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 121.416 1.411 . . . . 0.0 112.482 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.51 -44.36 89.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.273 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.43 -41.91 90.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.401 . . . . 0.0 110.523 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.15 -45.35 87.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.358 -177.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -58.8 -45.9 88.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.206 0.527 . . . . 0.0 110.235 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 34.5 mt -59.09 -41.33 87.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.556 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -58.16 -46.56 85.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.178 0.513 . . . . 0.0 110.149 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.8 ttp -57.72 -43.99 85.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.496 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.78 -46.58 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.553 -178.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.36 91.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.007 0.432 . . . . 0.0 110.352 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 95.7 mt -56.78 -43.16 80.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.565 -178.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -46.15 89.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.178 179.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.6 mtp85 -56.19 -42.35 77.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.206 -176.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 37.7 pt -89.47 14.07 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.92 23.13 70.03 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.282 172.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 117.516 0.658 . . . . 0.0 110.251 175.976 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.2 mmm . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.851 0.357 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.4 mt -56.2 -48.74 75.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.858 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.64 -49.04 79.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.289 -176.646 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.08 -53.49 49.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.39 -178.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.7 -44.74 81.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -178.825 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.14 -39.54 86.69 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.662 -179.18 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -58.06 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.94 0.4 . . . . 0.0 110.318 -178.774 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.4 -47.42 86.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.435 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.09 91.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.668 -178.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -59.35 -43.18 92.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.842 -178.371 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -59.11 -46.32 88.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.09 0.472 . . . . 0.0 110.095 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -125.72 108.88 11.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.33 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.16 -11.88 27.37 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 178.54 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.82 14.95 14.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.2 t -108.25 94.73 13.87 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.206 -0.426 . . . . 0.0 110.285 178.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -48.76 -34.53 27.98 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.411 1.407 . . . . 0.0 113.053 -175.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -58.03 -55.43 35.06 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.593 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.83 83.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.574 -179.042 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -59.81 -45.89 90.92 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.665 -178.924 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.53 74.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.003 0.43 . . . . 0.0 110.544 -176.297 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.82 92.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.307 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -59.17 -44.35 92.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.928 0.394 . . . . 0.0 110.834 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -57.73 -46.61 84.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.132 -178.765 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -58.55 -45.93 87.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.676 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.3 -44.51 88.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.542 -178.039 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.6 mt -60.96 -41.06 95.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.859 -176.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 12.6 mt -63.93 -46.11 86.22 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.611 179.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.79 -40.56 84.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.029 -177.677 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -84.85 15.99 3.62 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 61.75 50.86 4.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.792 177.01 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.9 49.15 3.0 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.275 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.51 -39.75 86.19 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 121.111 1.207 . . . . 0.0 111.765 -174.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.6 -37.94 68.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.0 -179.65 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.9 79.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.001 0.429 . . . . 0.0 110.176 -179.075 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.36 -42.72 68.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.247 179.249 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 44.8 t -65.57 -52.23 53.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.5 -177.618 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.1 m -54.87 -39.06 68.27 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.883 0.373 . . . . 0.0 111.191 -176.526 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -71.86 -52.72 16.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.592 -178.928 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.29 -32.91 65.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -176.228 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -76.81 -12.21 59.94 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.009 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 27.0 m -83.44 107.82 11.21 Favored Pre-proline 0 CA--C 1.535 0.385 0 CA-C-O 118.669 -0.681 . . . . 0.0 110.338 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.61 -16.62 25.05 Favored 'Trans proline' 0 N--CA 1.501 1.947 0 C-N-CA 121.249 1.299 . . . . 0.0 113.516 -174.689 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.03 -22.9 77.34 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.842 -177.1 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.9 140.77 18.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.567 0.683 . . . . 0.0 110.28 -176.305 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.51 156.05 20.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.569 0.699 . . . . 0.0 111.749 -176.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.0 p -142.23 137.89 31.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.405 176.53 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.9 p -126.02 163.23 40.95 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.522 177.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.08 -45.26 18.18 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.43 1.42 . . . . 0.0 112.472 178.728 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.33 -43.31 88.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.308 177.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.6 m -59.81 -41.51 91.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.554 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.07 -45.21 87.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.372 -178.28 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.73 -45.45 89.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.13 0.491 . . . . 0.0 110.207 179.725 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.3 mt -59.03 -40.94 86.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.712 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -58.78 -47.24 85.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.127 0.489 . . . . 0.0 110.256 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.2 ttp -57.95 -44.8 87.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.42 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.45 -45.15 89.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.538 -178.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.54 93.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.049 0.452 . . . . 0.0 110.496 -178.241 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.2 mt -56.56 -41.96 77.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.589 -178.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -60.7 -45.78 92.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.445 178.687 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 -56.19 -41.03 74.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.178 -177.111 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 36.0 pt -86.48 14.03 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -175.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.54 20.0 79.77 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 121.502 -0.38 . . . . 0.0 113.182 174.504 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 117.696 0.748 . . . . 0.0 109.848 177.39 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 72.8 mtm . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.789 0.328 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.4 -48.01 75.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.96 -178.634 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.04 79.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.372 -176.343 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.33 -51.79 61.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.907 0.384 . . . . 0.0 111.344 -178.217 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -56.8 -46.11 81.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.002 -179.037 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -59.83 -40.01 87.04 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.582 -179.033 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.34 -45.78 87.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.323 -178.482 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -60.29 -46.66 89.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.563 -178.681 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.05 89.52 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 -179.511 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 56.2 t-20 -59.05 -43.41 91.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.026 -177.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -60.07 -47.31 86.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.951 0.405 . . . . 0.0 110.133 -179.481 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -121.92 108.85 13.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.383 178.151 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.4 mt -95.65 -11.88 26.47 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 178.429 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 80.0 p -92.36 15.07 14.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.152 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.9 t -109.09 94.79 15.84 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.208 178.249 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -48.87 -35.19 30.59 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.411 1.407 . . . . 0.0 112.92 -175.437 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -57.77 -54.93 41.33 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.667 -179.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.7 81.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.576 -179.02 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -59.82 -47.05 87.29 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.689 -179.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.43 -46.34 73.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.883 0.373 . . . . 0.0 110.583 -175.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.53 91.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.245 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -58.63 -44.57 90.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.854 -179.15 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -57.71 -46.76 83.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.327 0.584 . . . . 0.0 110.114 -178.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -58.46 -46.41 86.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.678 -178.136 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 44.6 mt -58.67 -44.34 90.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.544 -178.088 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.4 mt -61.4 -40.68 95.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.946 -176.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 18.6 mt -64.92 -46.14 82.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.655 179.879 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.45 -39.71 84.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.693 0.283 . . . . 0.0 111.101 -177.792 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.3 m -85.64 16.42 3.94 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -176.774 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 58.3 t30 62.18 50.85 3.75 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.464 0.65 . . . . 0.0 110.848 176.705 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.95 48.68 2.73 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.397 177.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -57.3 -39.38 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.133 1.222 . . . . 0.0 111.694 -174.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.95 -38.18 69.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.021 -179.12 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -69.38 -41.61 76.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.905 0.383 . . . . 0.0 110.016 -179.047 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.6 t -55.34 -42.82 68.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.153 179.179 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -66.4 -52.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.646 -177.541 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 85.0 p -54.64 -37.7 65.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.832 0.349 . . . . 0.0 111.205 -176.666 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.92 -54.02 9.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.54 -179.077 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.64 -30.91 63.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.838 0.311 . . . . 0.0 111.838 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.81 -16.03 59.56 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 9.2 m -81.25 107.91 9.11 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.218 -179.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -57.62 -16.39 24.2 Favored 'Trans proline' 0 N--CA 1.502 1.994 0 C-N-CA 121.13 1.22 . . . . 0.0 113.501 -174.384 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -23.4 77.06 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 121.296 -0.478 . . . . 0.0 112.913 -177.074 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.23 140.73 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 117.51 0.655 . . . . 0.0 110.362 -176.076 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.48 156.05 20.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.637 0.732 . . . . 0.0 111.8 -176.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.1 p -144.15 137.89 27.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.418 176.237 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.2 p -125.55 163.53 38.17 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.259 177.671 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -45.97 -45.11 18.03 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 121.527 1.485 . . . . 0.0 112.456 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.34 -44.12 88.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.271 177.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.53 -41.23 89.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.545 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.04 -45.22 87.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.952 0.406 . . . . 0.0 110.427 -178.069 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -58.73 -45.79 88.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.138 0.494 . . . . 0.0 110.223 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.6 mt -58.72 -41.64 86.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.536 -179.838 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -58.63 -46.06 87.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.162 0.506 . . . . 0.0 110.375 179.661 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -58.08 -44.38 87.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.453 -178.995 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.74 -47.01 86.09 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.42 -177.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.72 90.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.063 0.458 . . . . 0.0 110.374 -178.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 93.7 mt -56.33 -43.47 79.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.594 -178.655 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.48 -46.47 88.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.228 179.715 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -56.73 -40.79 76.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.263 -176.896 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 41.0 pt -88.5 14.08 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.118 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.71 19.35 79.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.423 -0.418 . . . . 0.0 113.371 174.422 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 117.659 0.73 . . . . 0.0 110.17 176.78 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.919 0.39 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.43 -47.06 79.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.841 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.07 79.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.187 -176.63 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.54 -52.74 58.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.932 0.396 . . . . 0.0 111.341 -178.469 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.29 -44.94 80.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.078 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -59.81 -40.25 87.75 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.709 -178.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -58.27 -44.96 88.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.402 . . . . 0.0 110.346 -178.738 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -60.5 -46.19 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.571 -179.313 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.32 86.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.523 -179.218 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -59.27 -41.19 88.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.35 -46.93 87.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.054 0.454 . . . . 0.0 109.936 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -124.61 106.78 10.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.179 177.289 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -94.22 -11.86 29.43 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 178.947 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.06 14.97 14.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.557 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.02 94.84 15.75 Favored Pre-proline 0 CA--C 1.533 0.326 0 O-C-N 122.07 -0.394 . . . . 0.0 110.339 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.82 -32.8 23.39 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 121.362 1.374 . . . . 0.0 113.011 -175.279 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.23 -55.46 34.62 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.565 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.32 82.83 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.604 -179.257 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -59.86 -46.1 90.37 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.396 -0.522 . . . . 0.0 109.693 -179.032 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.9 -46.15 74.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 110.484 -176.174 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.87 92.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.264 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -59.11 -44.96 92.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.877 -179.192 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -57.72 -46.25 84.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.298 0.57 . . . . 0.0 110.09 -178.677 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -58.19 -47.04 84.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.57 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.2 mt -58.16 -43.4 87.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.527 -177.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.3 mt -61.07 -41.26 96.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.94 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.2 mt -64.59 -46.1 84.14 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.521 179.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -58.25 -40.82 82.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.014 -177.651 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.7 m -85.73 16.11 4.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.416 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 22.6 m120 61.63 51.63 3.92 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.474 0.654 . . . . 0.0 110.718 176.803 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -124.82 50.39 3.99 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.113 178.032 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -56.87 -40.47 83.96 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.184 1.256 . . . . 0.0 111.591 -175.614 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.7 -37.15 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.147 -179.667 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -69.04 -42.27 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.938 0.399 . . . . 0.0 110.154 -178.67 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 54.4 t -55.29 -41.88 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.249 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 57.9 t -65.7 -53.37 39.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.536 -178.481 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 84.7 p -54.37 -38.11 65.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.942 0.401 . . . . 0.0 111.283 -176.017 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.2 ttt85 -72.97 -53.65 10.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.599 -179.051 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.52 -29.35 64.26 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.028 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.89 -14.28 59.9 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.738 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.6 m -84.79 107.22 10.66 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.25 179.686 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.46 -14.53 21.03 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.208 1.272 . . . . 0.0 113.586 -174.384 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.92 -23.51 76.94 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.302 -0.475 . . . . 0.0 112.919 -177.633 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -98.35 139.97 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 117.483 0.642 . . . . 0.0 110.297 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.19 156.06 19.33 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.76 -176.746 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 66.4 p -141.84 137.95 31.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.356 176.56 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 78.0 p -125.95 163.5 39.08 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.447 177.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -46.24 -45.64 18.05 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 121.446 1.431 . . . . 0.0 112.262 178.33 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.22 -44.68 88.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.371 177.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 59.1 m -59.24 -41.55 88.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.408 . . . . 0.0 110.585 -179.454 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.15 -45.18 87.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.434 -177.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.12 -45.65 90.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.153 0.501 . . . . 0.0 110.322 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.0 mt -57.63 -42.89 84.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.425 -179.835 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -59.54 -47.41 85.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.292 -179.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.3 ttp -56.95 -43.04 81.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.638 -177.665 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -60.08 -49.14 78.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -178.459 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.08 -41.29 83.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.0 0.429 . . . . 0.0 110.496 -177.883 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 60.1 mt -57.05 -44.19 82.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.363 -179.077 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.55 -44.4 93.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.358 178.37 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -55.19 -42.0 72.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.122 -177.417 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 37.3 pt -89.33 14.02 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.82 16.53 79.9 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.331 -0.462 . . . . 0.0 113.429 174.434 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 117.765 0.783 . . . . 0.0 110.047 176.896 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 44.0 ttm . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.344 -0.613 . . . . 8.3699999999999992 109.344 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.2 t -109.76 132.37 58.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.201 -0.454 . . . . 5.0899999999999999 110.021 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.95 156.67 33.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 3.4500000000000002 110.552 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.2 t -97.82 137.92 24.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 2.8700000000000001 109.998 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 55.5 m -93.91 144.3 25.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 1.6200000000000001 110.825 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -79.03 -22.03 46.04 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.983 -0.553 . . . . 4.2000000000000002 112.463 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.88 -34.17 71.34 Favored 'General case' 0 C--N 1.334 -0.107 0 O-C-N 122.336 -0.228 . . . . 1.1799999999999999 111.485 -177.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.3 mtp -55.26 -47.19 75.81 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.833 0.349 . . . . 2.1400000000000001 110.939 -179.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.9 mt -56.15 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 1.24 110.804 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.03 79.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.333 -0.394 . . . . 1.04 111.295 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.5 m -53.5 -52.29 60.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 1.0700000000000001 111.395 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -45.16 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.31 -0.404 . . . . 2.6000000000000001 110.928 -179.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.11 -40.41 89.59 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.794 -0.362 . . . . 1.1499999999999999 110.67 -178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.38 -44.56 88.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 2.25 110.32 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.24 -45.52 92.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.13 -0.486 . . . . 2.02 110.53 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.59 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 1.03 110.589 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -59.04 -41.34 87.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 2.1200000000000001 110.923 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -58.81 -45.62 89.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.178 0.513 . . . . 2.9500000000000002 110.062 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -127.24 106.65 9.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 1.1299999999999999 110.225 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.1 mt -93.72 -11.89 30.45 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.806 0.669 . . . . 1.0600000000000001 112.806 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -92.29 14.98 14.76 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.894 0.702 . . . . 1.04 112.894 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.4 t -109.11 94.83 15.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 119.197 -0.43 . . . . 0.87 110.298 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -48.78 -31.69 20.17 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.422 1.414 . . . . 0.14000000000000001 113.213 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.72 -56.18 25.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.889 0.376 . . . . 2.02 110.591 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.86 -40.55 80.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 1.03 110.536 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -59.77 -47.47 85.57 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.628 -0.508 . . . . 0.10000000000000001 109.628 -179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.16 73.6 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 1.03 110.483 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.51 -45.48 91.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.869 -0.605 . . . . 0.98999999999999999 110.297 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -59.63 -43.5 93.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.462 -0.335 . . . . 0.12 110.857 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -57.41 -46.23 83.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.377 0.608 . . . . 0.10000000000000001 110.088 -179.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -46.15 88.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.717 -0.674 . . . . 2.1299999999999999 110.721 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.5 mt -58.11 -43.86 87.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.044 -0.525 . . . . 1.1799999999999999 110.578 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.02 -41.6 96.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 1.02 110.973 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.1 mt -64.3 -46.07 85.19 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.495 -0.482 . . . . 1.05 110.619 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -58.98 -40.06 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.495 -0.32 . . . . 2.27 111.021 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.5 m -85.87 16.32 4.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.219 0.822 . . . . 0.84999999999999998 113.219 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 62.04 50.79 3.9 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.496 0.665 . . . . 2.5699999999999998 110.752 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -124.92 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 115.954 -0.566 . . . . 0.83999999999999997 111.397 177.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -57.57 -39.42 88.54 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.142 1.228 . . . . 0.14999999999999999 111.663 -175.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.99 -37.86 69.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.294 -0.412 . . . . 2.5600000000000001 110.987 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.0 -42.77 80.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.985 0.421 . . . . 0.79000000000000004 109.945 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.9 t -55.45 -41.62 63.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.523 . . . . 1.02 110.306 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.5 t -66.83 -54.67 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 1.05 110.679 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 89.9 p -54.84 -38.92 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.034 0.445 . . . . 1.74 111.259 -175.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 64.5 ttt-85 -73.04 -50.27 23.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 1.03 111.75 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -56.95 -33.23 66.83 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.947 -0.301 . . . . 0.25 111.609 -176.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -76.86 -8.43 57.32 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.459 0.911 . . . . 1.6200000000000001 113.459 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.2 m -84.41 107.26 10.41 Favored Pre-proline 0 CA--C 1.536 0.413 0 CA-C-O 118.714 -0.66 . . . . 1.0700000000000001 110.175 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.7 -15.23 20.05 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 121.242 1.295 . . . . 0.23000000000000001 113.575 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.68 77.23 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 121.221 -0.514 . . . . 0.19 112.953 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -99.4 142.0 15.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-N 117.569 0.684 . . . . 1.03 110.471 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.74 156.13 28.07 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.65 -0.705 . . . . 1.01 111.725 -177.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 63.3 p -140.88 137.82 33.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.333 -0.849 . . . . 0.85999999999999999 110.506 176.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.8 p -125.77 163.18 40.74 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.666 -0.697 . . . . 0.77000000000000002 109.517 177.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -46.04 -45.83 17.1 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.542 1.495 . . . . 0.22 112.331 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.29 -43.4 88.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 2.04 110.344 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.61 -41.62 90.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.939 0.4 . . . . 0.92000000000000004 110.551 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.18 -45.79 86.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.989 0.423 . . . . 1.03 110.387 -178.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.73 -45.17 90.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.517 . . . . 1.1100000000000001 110.288 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.2 mt -58.41 -43.06 88.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.246 0.546 . . . . 1.05 110.45 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.52 -45.25 89.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.039 -0.528 . . . . 0.84999999999999998 110.402 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.29 -45.03 84.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.03 -0.532 . . . . 1.3100000000000001 110.468 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.33 -46.34 86.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.092 -0.504 . . . . 1.8500000000000001 110.448 -178.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.29 90.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 1.04 110.348 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.38 -42.79 78.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 1.0600000000000001 110.613 -178.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.76 -47.39 84.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 1.45 110.227 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -56.32 -41.68 76.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.874 -0.603 . . . . 2.3199999999999998 111.338 -176.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.6 pt -89.54 13.95 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 113.574 0.953 . . . . 1.05 113.574 -175.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 69.32 25.3 75.59 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 121.366 -0.445 . . . . 0.20999999999999999 113.027 173.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -97.12 86.03 3.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 117.359 0.579 . . . . 2.5299999999999998 110.211 176.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -66.56 -47.48 72.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 4.21 111.419 -177.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -55.95 -51.1 68.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.761 0.315 . . . . 1.8 111.166 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.15 -38.8 84.21 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.861 -0.335 . . . . 1.21 110.993 -177.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.69 -48.4 80.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.932 0.396 . . . . 1.0600000000000001 110.361 -178.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -55.24 -43.94 75.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.334 -0.393 . . . . 2.0 111.043 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.85 -47.68 82.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.396 -0.365 . . . . 1.0900000000000001 111.054 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.4 t -57.4 -46.29 85.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 121.015 -0.274 . . . . 1.04 110.534 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -53.0 -48.87 67.19 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.76 0.314 . . . . 3.8199999999999998 111.417 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -55.93 -39.06 71.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 1.99 110.981 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -62.17 -40.54 96.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.52 -0.309 . . . . 2.3599999999999999 110.707 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 77.9 mt -65.82 -37.99 87.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 1.46 111.121 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -55.96 -38.26 70.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.522 -0.308 . . . . 4.3600000000000003 111.078 -178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 51.1 t60 -129.18 100.9 5.79 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.811 0.339 . . . . 6.6299999999999999 110.451 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -66.54 -55.44 15.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 7.9000000000000004 110.767 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -150.1 -68.15 0.2 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 10.27 110.628 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -120.96 -41.03 2.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.356 -0.384 . . . . 12.9 110.606 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -106.54 139.27 41.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.286 -0.415 . . . . 16.02 110.605 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 77.2 m80 . . . . . 0 C--O 1.22 -0.47 0 CA-C-O 117.976 -1.012 . . . . 15.56 110.568 179.982 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.3 mtm . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.0 t -59.84 -43.23 91.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.006 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.04 146.49 43.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.63 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.6 m -129.23 142.11 44.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.36 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 60.6 p -94.03 148.03 22.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.767 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -60.74 -29.2 69.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.954 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.92 -36.3 74.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.534 0.207 . . . . 0.0 111.239 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.2 mtp -55.98 -46.38 78.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.936 0.398 . . . . 0.0 110.822 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.9 mt -56.32 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.787 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.12 78.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.282 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.5 -52.97 57.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.302 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.87 -44.35 82.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.014 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.41 -40.13 89.89 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.665 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.82 -44.5 86.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.877 0.37 . . . . 0.0 110.382 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -61.52 -48.04 82.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.541 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.69 90.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 -179.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.3 t-20 -61.45 -44.95 96.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.082 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -59.43 -45.28 92.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.988 0.423 . . . . 0.0 110.179 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -125.36 109.47 12.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.318 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 28.0 mt -96.76 -11.96 24.33 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -89.09 13.72 12.41 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.5 t -107.99 94.78 13.41 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.19 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -48.84 -36.06 32.69 Favored 'Trans proline' 0 N--CA 1.497 1.695 0 C-N-CA 121.366 1.378 . . . . 0.0 113.057 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.38 -54.43 46.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.3 84.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.557 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.56 -46.42 88.95 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.695 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.71 -46.73 74.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.944 0.402 . . . . 0.0 110.472 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.39 93.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.217 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -59.18 -45.02 92.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.976 0.417 . . . . 0.0 110.839 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -57.63 -46.4 84.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.254 0.55 . . . . 0.0 110.084 -178.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -58.69 -46.34 87.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.674 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.2 mt -58.33 -43.97 88.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.566 -178.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.27 -41.21 96.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.957 -176.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.11 -46.06 85.88 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.588 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -58.64 -40.98 84.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.759 0.314 . . . . 0.0 110.973 -177.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.2 m -84.58 15.3 3.85 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.4 t30 62.55 50.37 3.61 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.467 0.651 . . . . 0.0 110.87 177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -124.85 49.33 3.14 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.353 177.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -57.19 -39.08 93.15 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.116 1.211 . . . . 0.0 111.751 -174.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.98 -38.06 69.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -68.43 -42.3 79.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.027 0.442 . . . . 0.0 110.08 -179.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.42 -42.77 69.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.181 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -65.97 -52.31 50.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.593 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 86.5 p -54.91 -38.02 67.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.836 0.351 . . . . 0.0 111.199 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -72.44 -53.74 11.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.553 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -56.65 -31.6 64.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -76.82 -13.98 59.95 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -82.32 107.9 10.2 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.201 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -57.56 -16.35 23.74 Favored 'Trans proline' 0 N--CA 1.501 1.946 0 C-N-CA 121.238 1.292 . . . . 0.0 113.484 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.52 77.17 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 121.244 -0.503 . . . . 0.0 112.966 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 75.8 mt -100.02 141.4 17.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 117.57 0.685 . . . . 0.0 110.404 -176.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.39 156.18 26.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.722 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -143.81 137.82 28.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.411 175.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -124.67 165.03 27.24 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.417 177.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -45.91 -44.83 18.17 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 C-N-CA 121.442 1.428 . . . . 0.0 112.508 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.39 -43.81 88.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.269 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.65 -41.22 90.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.646 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.05 -45.4 87.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.356 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.03 -45.97 89.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.127 0.489 . . . . 0.0 110.272 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.6 mt -58.24 -41.6 84.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.63 -179.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -59.52 -46.51 88.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.454 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.7 ttp -57.57 -45.03 85.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.44 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.08 -46.16 88.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.501 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.51 92.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.1 mt -56.42 -43.55 79.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.99 0.424 . . . . 0.0 110.625 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.75 -46.23 89.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.222 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 33.0 mtp85 -56.69 -40.65 75.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -176.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.6 pt -87.97 13.98 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -175.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.63 19.57 79.84 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.358 -0.449 . . . . 0.0 113.289 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 -97.14 85.98 3.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.678 0.739 . . . . 0.0 110.138 176.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -68.33 -47.63 67.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.43 -176.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 84.5 p -56.04 -51.04 69.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.767 0.318 . . . . 0.0 111.181 -176.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -59.56 -39.45 84.1 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.894 -0.322 . . . . 0.0 110.974 -177.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.6 -47.81 82.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.331 . . . . 0.0 110.587 -177.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.48 -45.02 77.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.928 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.83 -49.86 75.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.284 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 49.3 t -57.73 -48.34 83.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.691 -178.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -53.82 -49.98 67.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.397 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -56.08 -39.64 72.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.941 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -58.61 -39.96 81.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.792 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.2 mt -58.69 -40.81 84.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.752 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -66.39 -41.61 89.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.723 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -146.59 142.9 28.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.623 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 82.4 t60 -106.18 131.27 53.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.448 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -133.75 177.38 7.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.49 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -96.41 142.01 29.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.492 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -102.94 139.26 38.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.604 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.565 179.984 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.3 m -132.55 154.83 40.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.585 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.95 134.91 34.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.61 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.1 t -119.08 136.13 57.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.936 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.4 m -60.04 113.02 2.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.488 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -73.78 -38.61 64.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.987 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.91 88.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.73 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.3 mmm -56.74 -50.18 73.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.849 0.357 . . . . 0.0 110.801 -178.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.72 -47.12 77.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.037 -178.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.95 -49.09 78.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.457 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.8 m -54.39 -52.29 62.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.95 0.405 . . . . 0.0 111.186 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -44.52 81.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.51 -40.52 91.73 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.679 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -58.34 -44.15 88.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.84 0.352 . . . . 0.0 110.409 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -61.02 -47.07 88.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.542 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.5 -46.23 89.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.676 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -59.49 -42.3 91.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.975 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.5 tttp -59.28 -46.52 88.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.079 0.466 . . . . 0.0 110.053 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -126.49 110.34 13.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.391 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.43 -11.95 26.74 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.13 14.91 14.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 18.9 t -108.13 94.81 13.78 Favored Pre-proline 0 CA--C 1.533 0.29 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.358 178.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -48.87 -34.66 29.08 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.37 1.38 . . . . 0.0 113.071 -174.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.09 -55.2 38.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.894 0.378 . . . . 0.0 110.584 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.09 -41.67 84.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.593 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.4 mm-40 -59.72 -45.89 90.8 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.351 -0.54 . . . . 0.0 109.675 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.73 75.24 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 110.466 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.15 -44.37 92.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.311 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.36 -44.87 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 110.776 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -57.61 -46.39 84.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.277 0.56 . . . . 0.0 110.054 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -45.51 90.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.732 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.6 mt -58.55 -44.66 89.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.513 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -61.11 -40.97 95.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.926 -176.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.9 mt -64.33 -46.04 85.22 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.583 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.07 -40.59 85.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.7 0.286 . . . . 0.0 110.981 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 63.7 m -85.36 17.14 3.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 61.53 50.9 4.3 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.424 0.631 . . . . 0.0 110.751 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.591 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.266 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.25 -39.5 89.6 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.134 1.222 . . . . 0.0 111.707 -174.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.5 -38.41 69.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.935 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.83 -41.88 77.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.969 0.414 . . . . 0.0 110.169 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.55 -42.45 68.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.205 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.6 t -66.44 -52.88 41.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.676 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.8 m -54.46 -38.3 66.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.925 0.393 . . . . 0.0 111.24 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -72.44 -53.62 11.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.487 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -56.46 -31.69 64.24 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.81 -13.19 60.04 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.0 m -84.29 107.73 11.93 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.266 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -57.59 -14.78 17.96 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 121.224 1.282 . . . . 0.0 113.57 -174.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -22.98 77.19 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.932 -177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -100.02 140.74 18.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 117.49 0.645 . . . . 0.0 110.301 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.93 156.1 21.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.754 -176.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -141.79 137.88 31.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.477 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 92.8 p -125.64 163.51 38.45 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.361 177.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -46.0 -44.96 18.37 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.445 1.43 . . . . 0.0 112.488 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -58.76 -44.05 90.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.275 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 60.4 m -59.59 -41.28 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.544 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.81 -45.1 86.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.435 -178.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -59.17 -46.12 89.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.191 0.519 . . . . 0.0 110.272 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 37.0 mt -58.73 -41.6 86.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.621 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -59.14 -46.37 88.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.164 0.507 . . . . 0.0 110.394 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.5 ttp -57.21 -44.56 83.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.527 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.78 -46.65 87.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.511 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.13 -44.0 92.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.279 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 95.8 mt -56.32 -43.35 78.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 110.672 -178.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.37 -46.35 88.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.242 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -57.38 -40.7 78.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.288 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 43.7 pt -89.05 14.06 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.99 24.45 75.81 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.467 -0.397 . . . . 0.0 113.141 173.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 55.6 mtp85 -97.12 91.0 5.35 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.515 0.658 . . . . 0.0 110.109 176.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -70.7 -44.75 66.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.55 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.6 t -55.99 -51.04 69.14 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.964 -0.295 . . . . 0.0 111.346 -174.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -62.51 -38.17 88.87 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.099 -176.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.92 -47.09 86.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.861 0.362 . . . . 0.0 110.466 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -56.16 -44.79 79.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.925 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.73 -48.57 79.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.23 -179.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.1 t -57.68 -47.64 85.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.589 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -53.22 -50.0 65.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.528 -178.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -56.47 -38.31 71.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.175 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -65.28 -41.97 93.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.213 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 81.5 mt -68.37 -38.85 81.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.155 -177.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -69.71 -39.17 77.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.126 -177.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -104.42 176.66 5.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.761 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -95.51 165.24 12.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.374 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -97.65 134.85 40.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.557 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -115.98 142.94 46.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -124.05 133.08 53.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.42 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.597 179.899 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.2 mtp . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.4 m -132.28 152.88 37.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.558 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.95 146.06 28.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.676 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -104.01 133.67 47.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 109.981 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.5 p -74.95 157.27 35.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.628 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -61.61 -36.68 81.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.308 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.08 89.25 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.935 -177.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.2 mtp -57.53 -48.06 80.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.801 0.334 . . . . 0.0 110.716 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 34.7 mt -55.36 -49.71 71.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 -178.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.07 79.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.487 -175.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.4 m -54.24 -52.83 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 111.26 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 87.4 mmt-85 -57.2 -44.24 83.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.89 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -60.26 -40.47 90.45 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.614 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -58.58 -45.63 88.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.837 0.351 . . . . 0.0 110.398 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.92 -46.82 89.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.616 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.77 90.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -59.0 -43.11 91.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.921 -177.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.71 -47.2 87.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.026 0.441 . . . . 0.0 110.177 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -121.54 108.76 13.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.392 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.0 mt -95.93 -11.88 25.95 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.19 14.92 14.76 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.6 t -108.63 94.87 14.96 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.332 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -48.86 -35.3 30.78 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.373 1.382 . . . . 0.0 113.05 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.56 -55.14 38.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.877 0.37 . . . . 0.0 110.653 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.67 83.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.563 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -59.67 -45.87 90.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.349 -0.541 . . . . 0.0 109.753 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.98 -46.76 75.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.976 0.417 . . . . 0.0 110.386 -176.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.22 92.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.216 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -59.16 -44.98 92.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.85 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -57.65 -46.4 84.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.319 0.58 . . . . 0.0 110.093 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -58.73 -46.34 87.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.638 -178.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.5 mt -58.19 -44.08 87.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 -178.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.4 mt -60.98 -40.99 95.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.8 mt -64.36 -46.09 84.95 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.596 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.87 -40.3 83.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.736 0.303 . . . . 0.0 110.996 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -85.7 16.24 4.12 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 29.5 m120 61.93 51.03 3.89 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.462 0.648 . . . . 0.0 110.715 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.83 49.99 3.67 Favored Pre-proline 0 CA--C 1.541 0.613 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.297 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -56.85 -38.92 94.76 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.18 1.253 . . . . 0.0 111.5 -175.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.12 -38.02 70.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.007 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -68.06 -42.24 80.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.986 0.422 . . . . 0.0 110.122 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.53 -42.38 68.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.17 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.69 -53.34 39.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 -177.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.9 m -54.65 -38.13 66.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.88 0.372 . . . . 0.0 111.212 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.86 -53.38 11.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.521 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -57.69 -30.53 65.56 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.876 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -76.89 -14.27 59.9 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -177.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.5 m -82.66 107.6 9.65 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.199 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.1 -16.98 29.53 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.19 1.26 . . . . 0.0 113.438 -174.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.38 77.01 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.314 -0.47 . . . . 0.0 113.011 -177.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.85 140.37 18.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.52 0.66 . . . . 0.0 110.401 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.7 156.08 24.62 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.621 0.724 . . . . 0.0 111.76 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.3 p -145.29 137.94 26.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.416 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.29 165.02 28.51 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.548 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -45.84 -44.41 18.34 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.467 1.445 . . . . 0.0 112.549 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -59.17 -43.53 92.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.187 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 81.7 m -59.6 -41.43 90.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.606 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.12 -45.71 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.409 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.68 -45.4 89.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.313 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.3 mt -58.28 -42.51 86.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.509 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -58.8 -45.78 89.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.5 ttp -57.16 -44.33 83.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.503 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -59.09 -46.97 86.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.445 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.47 -43.04 88.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.444 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.9 mt -56.8 -43.87 81.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.498 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -45.73 90.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.15 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -56.04 -42.97 77.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.214 -176.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 37.2 pt -90.47 14.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -174.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.59 27.1 70.05 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.021 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.8 mtt180 -97.08 88.81 4.6 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 117.315 0.558 . . . . 0.0 110.156 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -69.04 -49.43 57.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.306 -177.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -55.97 -51.1 68.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.78 0.324 . . . . 0.0 111.174 -176.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -59.67 -39.59 84.99 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.923 -177.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.28 -47.41 84.47 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.485 -177.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -55.52 -45.45 77.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.879 0.371 . . . . 0.0 110.98 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.86 -49.36 76.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.214 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 47.6 t -58.97 -48.29 87.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.678 -178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 61.0 ttp85 -53.71 -45.29 70.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.396 -177.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -55.87 -39.74 71.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.944 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -64.03 -41.29 97.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.869 0.366 . . . . 0.0 110.554 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.56 -32.22 73.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.646 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -51.3 -35.23 36.78 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -60.88 151.18 30.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.729 0.3 . . . . 0.0 110.446 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -129.01 147.4 50.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.497 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -103.61 131.24 50.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.42 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -56.12 -39.32 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.02 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -95.03 148.47 22.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.644 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.405 179.74 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -135.83 141.64 41.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.333 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.65 148.11 50.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.565 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.4 p -133.92 143.86 37.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.158 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 t -83.29 113.0 20.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.64 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -74.7 -35.13 62.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.344 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.99 88.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.666 0.269 . . . . 0.0 110.856 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp -56.04 -49.23 74.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.817 0.342 . . . . 0.0 110.964 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 14.5 mt -53.35 -52.02 60.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.205 -178.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.06 75.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.795 -174.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -53.57 -54.07 42.7 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.598 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 85.5 mtt180 -63.2 -38.26 90.48 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.844 -177.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -60.85 -39.47 89.25 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.529 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -59.24 -47.74 84.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.852 0.358 . . . . 0.0 110.194 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.81 -44.84 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.577 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.04 -47.55 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.621 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -59.5 -41.39 89.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.079 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.19 -47.63 85.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.085 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -121.62 109.72 15.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.32 178.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -94.65 -11.85 28.5 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.2 p -92.1 15.03 14.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -108.74 94.91 15.25 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 119.262 -0.399 . . . . 0.0 110.282 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -48.88 -36.77 34.9 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.319 1.346 . . . . 0.0 113.03 -175.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -57.19 -54.09 50.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.689 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.34 85.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.59 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.5 mm-40 -59.49 -45.54 91.39 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.758 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.41 -46.69 73.22 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 110.471 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.6 92.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.93 -44.25 94.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.936 0.398 . . . . 0.0 110.858 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -57.4 -45.97 83.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.324 0.583 . . . . 0.0 110.034 -179.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 32.9 mttm -59.16 -44.68 92.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.659 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 13.3 mt -58.06 -46.39 85.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.312 -178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.7 mt -60.04 -40.64 90.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.973 -175.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.6 mt -65.14 -46.16 82.09 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.692 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.03 -39.44 81.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.755 0.312 . . . . 0.0 111.092 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 63.9 m -86.92 16.97 4.39 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -176.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 62.27 50.27 3.92 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.458 0.646 . . . . 0.0 110.824 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -124.88 49.46 3.25 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.171 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -57.58 -39.37 88.89 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.123 1.215 . . . . 0.0 111.544 -175.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -56.03 -37.64 69.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.047 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.98 79.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 0.0 110.12 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.35 -41.88 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.23 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.12 -53.2 43.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.498 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.67 -38.35 66.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 111.234 -176.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -72.99 -53.2 11.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.605 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -57.47 -30.77 65.34 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.791 -175.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -76.93 -12.79 60.0 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -84.36 107.41 10.89 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.661 -0.685 . . . . 0.0 110.294 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.13 -15.71 24.32 Favored 'Trans proline' 0 N--CA 1.502 1.978 0 C-N-CA 121.229 1.286 . . . . 0.0 113.549 -174.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -22.82 77.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 121.262 -0.494 . . . . 0.0 112.873 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -99.3 140.33 18.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 117.608 0.704 . . . . 0.0 110.36 -176.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.07 156.13 22.26 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.584 0.707 . . . . 0.0 111.79 -176.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.6 p -141.63 137.87 32.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.413 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.1 p -124.57 163.45 36.63 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.419 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -46.08 17.37 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 121.453 1.435 . . . . 0.0 112.307 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.18 -42.84 86.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.25 -42.44 95.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.56 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -57.99 -44.32 87.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.029 0.442 . . . . 0.0 110.456 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -59.04 -46.19 88.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.191 0.519 . . . . 0.0 110.179 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.8 mt -57.7 -42.17 83.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -59.25 -46.62 88.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.429 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.4 ttp -57.39 -44.04 84.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.526 -178.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.43 -46.81 87.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.494 -178.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.97 89.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.067 0.461 . . . . 0.0 110.465 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.4 -43.74 79.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.61 -45.85 90.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.209 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -56.14 -41.52 75.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.256 -177.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.4 pt -88.51 14.19 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -175.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.53 22.2 79.1 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 121.373 -0.442 . . . . 0.0 113.206 174.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -97.1 85.97 3.85 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 117.58 0.69 . . . . 0.0 110.189 176.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -68.25 -46.92 69.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.296 -177.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 22.6 m -56.02 -51.08 69.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.79 0.329 . . . . 0.0 111.136 -176.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -59.47 -39.22 83.0 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.968 -177.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.23 -47.88 82.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.8 0.333 . . . . 0.0 110.538 -177.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -55.64 -44.59 77.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.991 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.99 -49.52 76.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.221 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 52.2 t -57.19 -48.5 82.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.636 -178.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -54.29 -50.13 68.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.199 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -56.56 -40.52 75.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.818 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -60.54 -37.84 82.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.115 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 25.3 mt -74.42 140.94 45.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.88 0.371 . . . . 0.0 110.756 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -128.88 128.57 44.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.274 179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -141.57 166.23 25.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.65 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -98.63 138.97 35.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.408 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -80.29 99.97 8.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.643 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 76.2 m80 -67.05 -40.81 87.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.739 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -78.68 136.73 37.52 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.567 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.574 -179.991 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 44.3 ttm . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.8 t -106.61 132.94 52.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.021 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.36 140.54 55.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.584 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -125.09 133.9 68.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.219 -0.446 . . . . 0.0 109.922 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 53.8 m -93.97 149.15 21.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.622 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -59.41 -35.53 74.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.333 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.96 -38.55 79.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.68 0.276 . . . . 0.0 110.958 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.8 mtp -56.31 -45.19 80.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.8 mt -56.39 -47.85 78.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.818 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.4 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.297 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.48 -53.06 56.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.891 0.377 . . . . 0.0 111.329 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -56.35 -44.47 80.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.076 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.56 -40.43 91.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.644 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -58.16 -44.4 87.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.383 . . . . 0.0 110.435 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.64 -47.53 85.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.439 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.29 -46.04 89.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.658 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -59.05 -42.58 90.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.88 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.25 -46.81 87.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.091 0.472 . . . . 0.0 110.07 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -124.42 108.67 12.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.262 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.6 mt -94.84 -11.85 28.07 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.9 15.01 13.97 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 16.7 t -108.83 94.92 15.47 Favored Pre-proline 0 CA--C 1.533 0.314 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.283 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -48.93 -34.96 30.34 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.344 1.362 . . . . 0.0 112.889 -175.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -57.68 -54.86 42.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.908 0.385 . . . . 0.0 110.672 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.95 84.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.557 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.0 mm-40 -59.42 -45.3 91.92 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.812 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.93 -47.46 74.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.911 0.386 . . . . 0.0 110.388 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.39 92.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.338 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -58.92 -44.9 91.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -57.72 -46.47 84.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.338 0.589 . . . . 0.0 110.188 -178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.619 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.6 mt -58.39 -44.31 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.496 -178.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.7 mt -61.48 -41.21 96.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.03 -176.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 20.1 mt -64.17 -46.16 85.22 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -59.08 -40.66 85.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.107 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.2 m -84.82 16.12 3.52 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 61.76 51.14 3.99 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.547 0.689 . . . . 0.0 110.676 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.83 49.36 3.15 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.302 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -56.63 -39.85 88.47 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.144 1.23 . . . . 0.0 111.588 -175.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -55.71 -38.22 69.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.065 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.26 -42.66 79.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.031 0.443 . . . . 0.0 110.094 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.39 -42.84 69.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.158 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.13 -52.09 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.578 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -54.57 -38.23 66.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.923 0.392 . . . . 0.0 111.259 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.2 ttt85 -72.57 -53.84 10.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.576 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -56.72 -31.28 64.36 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.59 59.99 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.6 m -83.7 107.54 10.58 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.214 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -57.78 -16.26 24.63 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 121.266 1.311 . . . . 0.0 113.573 -174.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.62 77.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.972 -177.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.0 mt -99.62 139.76 20.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 117.524 0.662 . . . . 0.0 110.34 -176.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.72 156.06 17.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.673 0.749 . . . . 0.0 111.635 -177.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.7 p -149.14 137.88 21.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.399 176.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 p -124.9 165.03 27.74 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.442 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -45.97 -44.77 18.45 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.472 1.448 . . . . 0.0 112.48 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -58.07 -44.47 87.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.987 0.422 . . . . 0.0 110.289 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.5 m -59.11 -41.41 88.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 24.3 mtp -57.71 -43.57 85.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.456 -178.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.71 -46.26 87.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.121 0.486 . . . . 0.0 110.169 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.5 mt -58.54 -41.9 86.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -58.75 -45.67 89.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.174 0.511 . . . . 0.0 110.358 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 59.7 ttp -58.62 -44.25 89.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.586 -179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.59 -45.74 88.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.47 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.4 91.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.345 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.6 mt -56.33 -42.9 78.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.689 -178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.14 -46.85 87.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.214 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 22.0 mtp85 -56.12 -41.84 75.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.236 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.5 pt -88.39 13.95 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 70.24 24.18 76.81 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.398 -0.429 . . . . 0.0 113.056 174.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 -97.02 85.95 3.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 117.47 0.635 . . . . 0.0 110.287 176.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -67.08 -47.17 72.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.319 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 21.1 m -56.01 -50.95 69.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.861 0.362 . . . . 0.0 111.173 -176.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -60.26 -38.17 82.67 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.913 -177.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -60.67 -47.82 84.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.143 0.497 . . . . 0.0 110.2 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -55.44 -42.45 74.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.975 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.9 -48.75 78.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.021 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 46.6 t -55.79 -46.13 79.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.566 0.222 . . . . 0.0 110.69 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -52.98 -49.97 65.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.786 0.326 . . . . 0.0 111.308 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.05 -39.81 72.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.891 179.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -60.25 -39.64 87.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.82 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.0 mt -79.1 136.54 37.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.431 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -146.53 -56.98 0.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.79 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -111.76 127.12 55.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.676 -178.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -149.97 105.85 3.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.492 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -150.01 -69.27 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.688 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -98.33 -40.41 8.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.784 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -60.58 143.42 53.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.591 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.685 -179.806 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.7 ttm . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.3 m -123.35 -39.71 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.72 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.63 146.61 54.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.546 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.7 m -130.19 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.362 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 79.4 p -91.82 151.05 20.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.654 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -78.92 -24.81 43.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.034 -0.53 . . . . 0.0 112.347 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.93 -38.54 79.19 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.629 0.252 . . . . 0.0 110.936 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 73.3 mtm -56.35 -46.56 79.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.891 0.377 . . . . 0.0 110.787 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.7 mt -56.43 -47.0 79.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.8 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.0 79.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.237 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.37 -53.24 53.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.907 0.384 . . . . 0.0 111.404 -178.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 83.1 mmt-85 -56.57 -44.09 80.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.055 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -60.43 -40.63 91.76 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.581 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.94 -43.96 86.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.97 0.414 . . . . 0.0 110.439 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -60.77 -47.91 84.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.478 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.12 -45.7 90.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.636 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -59.04 -42.88 91.3 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.819 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -59.29 -46.51 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.076 0.465 . . . . 0.0 109.991 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -125.68 109.08 12.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.386 177.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -95.27 -11.9 27.13 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -91.33 14.86 13.34 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.2 t -108.78 94.79 15.08 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-O 119.273 -0.394 . . . . 0.0 110.244 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.8 -34.75 28.89 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.302 1.335 . . . . 0.0 113.037 -175.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -57.71 -55.15 38.61 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.665 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.34 83.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.495 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.9 mm-40 -59.64 -46.09 90.04 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.668 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.75 -46.82 74.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.95 0.405 . . . . 0.0 110.434 -176.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.52 -44.47 93.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.278 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.85 -44.95 91.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -57.85 -46.62 84.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.267 0.556 . . . . 0.0 110.045 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -58.63 -45.44 89.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.43 -44.97 89.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.553 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.15 -40.62 94.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.884 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.3 mt -64.34 -46.09 85.01 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.619 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -58.69 -40.93 85.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.015 -177.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.61 16.1 3.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 62.0 50.58 4.04 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.431 0.634 . . . . 0.0 110.78 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.85 49.4 3.19 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.167 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -57.61 -38.55 93.17 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.091 1.194 . . . . 0.0 111.688 -174.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.09 -38.19 70.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.0 -42.5 80.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.017 0.437 . . . . 0.0 110.081 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.0 t -55.53 -42.81 69.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.204 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.92 -52.34 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.54 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.6 67.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 111.157 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.2 -53.19 13.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.55 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -56.55 -32.5 65.2 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.656 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -76.85 -11.34 59.81 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -85.01 107.34 11.35 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-O 118.753 -0.641 . . . . 0.0 110.253 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.79 -15.64 22.19 Favored 'Trans proline' 0 N--CA 1.502 1.998 0 C-N-CA 121.26 1.307 . . . . 0.0 113.499 -174.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.85 -22.6 77.01 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.972 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.7 mt -99.99 140.29 19.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.515 0.657 . . . . 0.0 110.339 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.7 156.1 17.61 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.593 0.711 . . . . 0.0 111.722 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.81 137.88 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.465 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 95.8 p -125.98 163.35 40.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.391 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.02 -45.37 17.78 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.446 1.43 . . . . 0.0 112.422 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -58.26 -43.2 87.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.962 0.41 . . . . 0.0 110.369 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.4 m -59.98 -41.87 92.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.3 mtp -57.91 -44.8 87.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.964 0.411 . . . . 0.0 110.403 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.81 -45.75 89.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.303 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.5 mt -58.62 -40.91 84.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.615 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -59.46 -47.41 85.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.106 0.479 . . . . 0.0 110.495 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.1 ttp -57.65 -44.54 85.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.459 -178.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.26 -45.88 90.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.459 -177.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.95 -43.82 91.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.137 0.494 . . . . 0.0 110.496 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.58 -43.29 79.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.535 -178.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.83 -46.07 90.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.308 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -56.39 -40.81 75.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.225 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 39.6 pt -87.53 13.99 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.65 17.64 80.04 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 121.326 -0.464 . . . . 0.0 113.429 174.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt-85 -97.14 86.01 3.84 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 117.704 0.752 . . . . 0.0 110.097 176.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -71.99 -44.56 63.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.218 -176.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -56.14 -50.93 69.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 111.093 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -59.08 -41.08 87.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.948 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.0 -47.55 84.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.67 -177.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.51 -45.57 77.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.956 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.92 -49.27 77.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.307 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.23 -50.53 76.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.735 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -54.11 -49.98 67.91 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.733 0.301 . . . . 0.0 111.319 -177.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -58.27 -37.95 76.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.008 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -65.21 -32.87 74.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.769 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 79.5 mt -57.16 -58.79 6.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.67 0.272 . . . . 0.0 111.422 -177.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -78.49 -46.16 20.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.461 -176.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -55.04 -43.03 73.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.188 -177.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 69.9 m80 -102.81 152.29 21.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.615 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -73.19 154.62 40.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.581 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -56.95 -43.96 82.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.695 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.4 -45.72 93.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.58 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.596 179.941 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.9 ttm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.4 m -132.55 154.87 40.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.517 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.45 134.61 35.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.593 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.5 m -131.29 151.0 34.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.46 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.2 p -93.95 153.34 18.26 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.636 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.2 p80 -59.14 -31.0 68.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.716 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.97 -40.8 85.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.686 0.279 . . . . 0.0 110.78 -178.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.9 mtp -57.09 -48.4 78.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.014 0.435 . . . . 0.0 110.65 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.0 mt -56.36 -44.55 80.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.739 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.2 m -53.48 -53.63 48.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.856 0.36 . . . . 0.0 111.306 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -56.47 -44.13 80.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.021 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -60.6 -40.56 92.23 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.657 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -57.94 -44.14 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.408 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.89 -48.0 83.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.568 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.75 90.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.686 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -60.27 -44.05 95.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.919 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -58.9 -45.23 90.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.059 0.457 . . . . 0.0 110.127 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -126.41 107.69 10.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.324 177.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.5 mt -95.03 -11.94 27.5 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.2 p -91.68 15.06 13.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -107.85 94.87 13.3 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 119.284 -0.388 . . . . 0.0 110.151 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -48.85 -34.43 28.26 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.413 1.408 . . . . 0.0 113.056 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -58.24 -55.21 37.98 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.587 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.41 82.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.609 -179.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -59.71 -46.36 89.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.756 -179.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.69 -46.79 74.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.921 0.391 . . . . 0.0 110.486 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.32 -45.21 91.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.263 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -59.13 -43.95 91.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.897 -178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -57.58 -46.23 84.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 110.15 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -59.05 -44.85 91.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.678 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.54 -45.28 89.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.528 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.9 mt -60.44 -41.11 93.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.3 mt -64.05 -46.15 85.64 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.666 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -58.85 -40.34 83.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.756 0.313 . . . . 0.0 111.147 -177.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.4 m -84.49 15.61 3.62 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 62.14 50.53 3.93 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.463 0.649 . . . . 0.0 110.727 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.93 49.44 3.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.228 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -57.15 -39.67 88.88 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.135 1.224 . . . . 0.0 111.673 -175.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -55.46 -38.03 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.995 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.46 -42.42 78.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.943 0.402 . . . . 0.0 110.135 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.2 t -55.37 -42.25 66.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.25 -52.45 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.552 -177.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.74 -38.62 67.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 0.0 111.204 -176.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.1 ttt85 -72.21 -53.31 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.531 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -56.58 -31.6 64.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 -176.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -76.89 -12.62 59.98 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.4 m -84.66 107.44 11.33 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.149 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.91 -14.83 19.62 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 C-N-CA 121.232 1.288 . . . . 0.0 113.581 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -23.03 77.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 121.196 -0.526 . . . . 0.0 112.906 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -99.85 140.16 19.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 117.446 0.623 . . . . 0.0 110.235 -176.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.36 156.1 19.81 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.507 0.67 . . . . 0.0 111.65 -177.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.4 p -144.19 137.93 27.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.404 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.11 165.12 29.36 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.477 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -45.94 -44.31 18.85 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.442 1.428 . . . . 0.0 112.474 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -58.43 -44.86 89.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.962 0.41 . . . . 0.0 110.258 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.2 m -59.1 -41.62 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.458 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.77 -45.74 85.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.956 0.408 . . . . 0.0 110.39 -178.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -58.83 -45.67 89.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.216 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 38.1 mt -58.77 -41.06 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.68 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -59.53 -47.33 85.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.129 0.49 . . . . 0.0 110.456 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.6 ttp -57.53 -44.14 84.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.451 -178.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -59.3 -46.38 88.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.565 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.121 0.486 . . . . 0.0 110.415 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 93.8 mt -56.48 -43.25 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.642 -178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.91 -46.27 89.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.379 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -56.41 -40.47 74.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.241 -177.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.0 pt -87.49 13.98 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 113.456 0.909 . . . . 0.0 113.456 -175.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 78.61 15.26 81.1 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 121.322 -0.466 . . . . 0.0 113.506 174.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 86.8 mtt-85 -97.11 85.92 3.83 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.777 0.789 . . . . 0.0 110.144 177.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -72.87 -44.81 60.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.28 -176.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -56.03 -50.95 69.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.808 0.337 . . . . 0.0 111.1 -176.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -59.17 -39.14 81.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.933 -177.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.1 -48.06 81.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.882 0.372 . . . . 0.0 110.582 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -55.67 -44.8 77.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.939 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.91 -49.58 76.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.244 -179.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 53.8 t -56.94 -48.2 81.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.991 -0.283 . . . . 0.0 110.677 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -54.02 -49.98 67.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.698 0.285 . . . . 0.0 111.258 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -56.94 -39.4 74.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.845 178.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -56.98 -38.53 73.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.006 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 79.4 mt -64.79 88.03 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.789 0.328 . . . . 0.0 110.497 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -72.25 -38.52 68.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.016 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -93.86 145.74 24.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.828 0.346 . . . . 0.0 110.709 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -108.07 150.59 26.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.383 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -78.67 100.1 6.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.562 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -91.5 -42.71 10.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.775 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -110.35 143.21 40.93 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.483 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.54 179.937 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.2 mtm . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.8 t -109.15 133.83 53.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.019 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.58 148.27 52.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.56 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.4 t -99.88 134.32 39.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.024 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.5 m -67.19 140.45 57.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -65.21 -30.38 71.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.835 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -35.66 73.56 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.468 0.175 . . . . 0.0 111.365 -177.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.1 mtp -55.89 -48.88 74.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.933 0.397 . . . . 0.0 110.85 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.6 mt -56.59 -44.4 81.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.759 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.04 79.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.334 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.31 -53.25 53.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.998 0.428 . . . . 0.0 111.346 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -56.86 -45.6 82.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.926 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -59.88 -39.28 84.76 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.761 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -58.06 -45.14 87.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.91 0.386 . . . . 0.0 110.336 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -60.29 -48.07 83.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.362 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.03 -45.87 89.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.603 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -59.32 -42.25 90.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -59.02 -46.33 88.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.022 0.439 . . . . 0.0 110.073 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -127.07 110.91 13.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.495 177.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 96.5 mt -94.13 -11.87 29.6 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 178.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.29 15.08 12.73 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.9 t -108.13 94.79 13.72 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.332 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.93 -39.09 39.85 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.381 1.387 . . . . 0.0 113.14 -175.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -56.81 -51.71 67.91 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.825 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.38 -42.99 92.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.568 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -59.3 -45.19 91.97 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.76 -179.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.22 -47.21 72.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.978 0.418 . . . . 0.0 110.454 -176.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.46 -44.93 92.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.21 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -58.76 -44.51 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 0.0 110.839 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -57.65 -46.8 83.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.277 0.561 . . . . 0.0 110.041 -178.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -58.56 -46.04 87.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.697 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.31 -44.22 88.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.571 -178.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.3 mt -60.79 -41.28 95.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.866 -176.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.4 mt -64.47 -46.17 84.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.742 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -59.17 -39.82 83.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.056 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 73.6 m -84.76 15.4 3.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 62.46 50.1 3.81 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.499 0.666 . . . . 0.0 110.869 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -124.88 48.91 2.82 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.421 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.86 -38.27 93.17 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.147 1.231 . . . . 0.0 111.643 -175.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -56.22 -38.21 70.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.01 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.06 -42.12 80.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.044 0.45 . . . . 0.0 110.109 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.62 -43.25 72.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.145 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 45.8 t -65.95 -52.21 51.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.6 -177.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -55.02 -39.06 68.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.831 0.348 . . . . 0.0 111.092 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -72.36 -51.95 18.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.547 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -57.0 -31.62 65.28 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -76.89 -10.06 59.11 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 12.7 m -86.26 106.87 11.22 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.211 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -57.64 -15.0 18.85 Favored 'Trans proline' 0 N--CA 1.5 1.898 0 C-N-CA 121.311 1.341 . . . . 0.0 113.571 -174.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -23.25 77.11 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 121.286 -0.483 . . . . 0.0 112.872 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -98.64 139.77 19.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 117.542 0.671 . . . . 0.0 110.385 -176.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.14 156.1 19.04 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.665 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -144.6 137.84 27.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.515 176.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.86 164.97 29.86 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.414 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -45.81 -43.35 19.29 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 121.454 1.436 . . . . 0.0 112.488 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -59.88 -43.93 94.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.098 178.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.1 m -59.65 -41.46 90.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.572 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.3 mtp -58.13 -45.47 87.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.979 0.419 . . . . 0.0 110.342 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.51 -45.29 89.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.204 0.526 . . . . 0.0 110.231 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 38.7 mt -59.28 -41.22 88.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.611 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -58.08 -45.2 87.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.07 0.462 . . . . 0.0 110.218 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 16.5 ttm -57.74 -45.91 85.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -57.81 -45.26 86.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.513 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.75 91.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.969 0.414 . . . . 0.0 110.306 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 95.1 mt -56.59 -43.34 80.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.037 0.446 . . . . 0.0 110.532 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.5 -44.39 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.391 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 18.0 mtp180 -56.42 -42.67 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 37.8 pt -88.49 14.15 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -174.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.9 23.34 69.57 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.276 -0.487 . . . . 0.0 113.305 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -97.11 85.99 3.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 117.448 0.624 . . . . 0.0 110.172 175.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -67.9 -49.85 59.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.282 -176.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.2 m -55.89 -51.12 68.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.738 0.304 . . . . 0.0 111.301 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -59.43 -40.73 87.68 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.049 -176.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.16 -47.41 84.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.847 0.356 . . . . 0.0 110.667 -177.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -55.63 -45.32 77.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.962 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.92 -50.09 74.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.325 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.1 t -57.48 -49.02 81.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.672 -177.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -54.61 -49.86 69.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.254 -178.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.03 -39.3 71.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.076 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -58.27 -40.34 81.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.828 0.347 . . . . 0.0 110.771 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.1 -38.65 87.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.933 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -56.63 -38.93 72.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.944 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -100.33 174.25 6.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.833 0.349 . . . . 0.0 110.578 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.2 m80 -95.35 167.5 11.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.567 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -95.04 134.62 37.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.484 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -57.61 -61.09 2.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.739 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 21.7 m80 -150.03 136.2 18.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.676 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.505 179.861 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.2 t -106.81 133.27 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.019 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.07 135.59 36.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.562 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.6 p -137.17 141.32 40.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.211 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 42.6 t -94.04 137.81 32.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.636 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -64.51 -36.84 85.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.229 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.49 84.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.762 0.315 . . . . 0.0 110.76 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.8 mtt -56.79 -43.61 81.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.836 0.35 . . . . 0.0 110.751 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.6 mt -56.18 -49.65 73.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.824 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.0 -49.05 79.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.249 -176.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.4 m -53.4 -53.02 57.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.393 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -56.37 -44.3 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.992 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.04 -41.73 92.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.609 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -58.31 -44.03 88.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.79 0.329 . . . . 0.0 110.437 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.16 -47.12 87.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.547 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.52 -46.22 89.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.593 -179.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -59.7 -41.91 91.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -59.5 -46.88 87.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.134 0.492 . . . . 0.0 109.977 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -123.54 106.3 10.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.197 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -93.44 -12.0 30.81 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.26 15.0 14.66 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.6 t -108.03 94.84 13.6 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.351 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -48.75 -34.79 28.69 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.432 1.421 . . . . 0.0 113.155 -174.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.59 -54.91 41.77 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.621 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.1 83.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.53 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -59.77 -46.84 87.93 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.694 -178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.79 -46.84 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.925 0.393 . . . . 0.0 110.518 -176.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.27 -44.68 92.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.65 -44.22 93.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.922 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -57.65 -46.23 84.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.321 0.582 . . . . 0.0 110.117 -178.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -59.3 -45.14 92.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.679 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.7 mt -59.05 -44.75 91.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.6 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.0 mt -61.11 -41.11 96.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.912 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.17 -46.05 85.71 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.634 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.15 -40.57 85.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.713 0.292 . . . . 0.0 110.931 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.9 m -84.36 16.31 3.15 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 61.78 50.62 4.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.477 0.656 . . . . 0.0 110.842 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.86 48.58 2.64 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.58 -39.46 88.13 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 121.109 1.206 . . . . 0.0 111.773 -174.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -55.55 -38.21 68.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.04 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.37 -42.86 78.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.019 0.438 . . . . 0.0 109.992 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.3 t -55.3 -42.63 67.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.307 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.7 t -67.05 -53.62 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.716 -176.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 21.6 t -54.83 -39.37 68.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.973 0.416 . . . . 0.0 111.153 -176.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.6 ttt-85 -72.98 -50.47 23.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.692 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.6 -32.84 65.65 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.584 -177.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -76.93 -7.55 55.76 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -177.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 39.2 m -86.67 106.73 11.31 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.105 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_exo -57.42 -13.96 14.8 Favored 'Trans proline' 0 N--CA 1.502 2.002 0 C-N-CA 121.234 1.289 . . . . 0.0 113.667 -174.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -24.13 76.58 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.252 -0.499 . . . . 0.0 112.857 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.2 mt -98.01 142.04 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 117.386 0.593 . . . . 0.0 110.397 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.27 156.21 26.21 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.554 -177.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.1 p -146.19 137.86 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.543 176.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -123.56 165.09 24.64 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.365 177.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.91 -44.97 18.02 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.439 1.426 . . . . 0.0 112.509 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.44 -43.31 88.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.318 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.0 m -60.11 -42.86 95.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.865 0.364 . . . . 0.0 110.589 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -57.97 -43.4 86.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.441 -178.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -59.04 -46.45 88.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.146 0.498 . . . . 0.0 110.083 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 35.6 mt -58.52 -41.0 84.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.647 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 38.7 t80 -58.81 -45.35 90.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.084 0.469 . . . . 0.0 110.387 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 15.1 ttm -57.92 -45.82 85.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.407 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -57.84 -45.49 86.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.521 -176.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.15 -45.73 92.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.979 0.419 . . . . 0.0 110.402 -178.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 90.4 mt -56.65 -42.68 79.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.005 0.431 . . . . 0.0 110.629 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -60.99 -45.37 95.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.408 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.3 mtp180 -56.63 -41.36 77.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.114 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -87.44 13.99 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.89 21.36 79.84 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.428 -0.415 . . . . 0.0 113.265 173.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -97.02 85.91 3.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 117.626 0.713 . . . . 0.0 110.146 176.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -70.06 -46.39 65.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.351 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 85.8 p -56.06 -50.95 69.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.793 0.33 . . . . 0.0 111.127 -175.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -59.24 -39.45 82.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.918 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.23 -47.74 83.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.83 0.348 . . . . 0.0 110.633 -177.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -55.28 -45.26 76.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.99 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.85 -49.54 76.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.155 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 51.2 t -57.03 -48.56 81.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 120.936 -0.305 . . . . 0.0 110.701 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -53.9 -50.02 67.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 111.332 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -56.63 -39.78 74.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.869 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -57.07 -36.83 71.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.136 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 81.7 mt -77.9 123.6 26.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.778 0.323 . . . . 0.0 110.79 -179.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 40.1 mp0 -85.86 -41.54 14.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.611 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -111.25 146.41 37.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.696 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 59.1 t60 -137.11 137.19 39.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.436 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -103.81 133.67 48.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.576 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -58.23 -40.6 82.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.733 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -79.91 144.32 33.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.564 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.581 -179.872 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.1 t -116.41 132.08 67.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.927 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.8 145.31 55.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.525 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 22.4 m -91.42 123.02 43.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.649 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.9 t -93.97 146.25 24.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.739 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -54.84 -35.28 63.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.292 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.95 -34.26 71.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.392 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.2 mtt -55.2 -44.97 75.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.921 0.391 . . . . 0.0 110.943 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.2 mt -56.49 -47.65 78.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.745 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -48.98 79.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.121 -177.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.03 -53.2 53.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.892 0.377 . . . . 0.0 111.474 -178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 82.7 mmt-85 -56.28 -44.51 79.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.954 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -60.34 -39.93 88.87 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.68 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.99 -44.14 87.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.976 0.417 . . . . 0.0 110.389 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -60.88 -47.43 86.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.526 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.36 -45.39 91.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.664 -179.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.32 -42.83 92.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.905 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -59.51 -47.08 86.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.087 0.47 . . . . 0.0 109.982 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.4 108.81 12.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.302 177.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.9 mt -95.92 -11.92 25.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.33 14.76 13.62 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.0 t -108.53 94.78 14.55 Favored Pre-proline 0 CA--C 1.533 0.294 0 O-C-N 122.042 -0.411 . . . . 0.0 110.183 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.86 -34.37 28.12 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.431 1.421 . . . . 0.0 112.894 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.13 -55.33 36.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.816 0.341 . . . . 0.0 110.679 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.02 81.62 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.569 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.7 mm-40 -59.85 -46.46 89.22 Favored 'General case' 0 N--CA 1.461 0.12 0 C-N-CA 120.382 -0.527 . . . . 0.0 109.672 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.47 74.09 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.936 0.398 . . . . 0.0 110.506 -176.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.99 92.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.247 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -58.72 -45.01 90.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 110.869 -179.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -57.64 -46.55 84.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.371 0.605 . . . . 0.0 110.104 -178.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.5 mttt -58.82 -45.59 89.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.757 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.8 mt -58.47 -44.47 89.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.522 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.16 -41.13 96.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.959 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 13.8 mt -64.1 -46.07 85.85 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.492 179.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.53 -41.44 85.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.738 0.304 . . . . 0.0 111.0 -177.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.52 16.11 3.35 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 61.88 51.18 3.87 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.474 0.654 . . . . 0.0 110.695 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -124.91 49.77 3.53 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.116 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -56.42 -39.87 88.39 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 121.183 1.256 . . . . 0.0 111.575 -175.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.57 -38.1 68.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.114 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.32 -42.4 79.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.07 0.462 . . . . 0.0 110.117 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.75 -42.47 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.185 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.0 t -66.23 -52.19 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -177.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -54.54 -38.15 66.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.0 111.23 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.7 ttt85 -72.89 -53.94 10.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.499 -178.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -56.64 -31.21 64.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.35 60.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -84.67 107.06 9.98 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.207 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -58.16 -15.22 22.31 Favored 'Trans proline' 0 N--CA 1.501 1.912 0 C-N-CA 121.31 1.34 . . . . 0.0 113.571 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -23.55 76.99 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 121.305 -0.474 . . . . 0.0 112.856 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.9 mt -98.15 139.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 117.529 0.664 . . . . 0.0 110.362 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.32 156.05 16.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.693 0.759 . . . . 0.0 111.594 -176.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -143.33 137.95 29.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.348 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.5 p -125.35 163.48 38.07 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.304 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -45.96 -45.11 17.97 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 121.378 1.385 . . . . 0.0 112.476 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -58.36 -43.97 88.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.317 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.81 -41.5 91.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -57.91 -44.94 87.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.954 0.407 . . . . 0.0 110.442 -178.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.95 -46.22 88.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.248 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.6 mt -58.26 -40.83 82.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.678 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -59.37 -47.62 84.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.415 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.2 ttp -57.43 -42.93 83.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -59.22 -47.38 85.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.543 -178.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.77 -43.45 90.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.019 0.437 . . . . 0.0 110.364 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.7 mt -56.68 -43.77 80.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.588 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.3 -46.04 89.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.151 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.4 mtp85 -56.42 -42.19 77.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.284 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 38.3 pt -89.47 14.16 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -174.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.65 25.59 69.56 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.309 -0.472 . . . . 0.0 113.154 173.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -97.06 89.01 4.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 117.448 0.624 . . . . 0.0 110.109 175.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -68.45 -51.14 46.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.379 -176.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.2 t -55.98 -51.06 69.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 0.0 111.214 -175.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -59.51 -40.8 88.27 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.986 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.98 -46.94 87.06 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.618 -177.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.34 -45.97 76.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.981 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.96 -49.61 76.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.359 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.09 -48.83 83.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.746 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 70.6 ttp85 -54.14 -48.43 70.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.283 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -55.93 -39.77 72.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.947 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -61.41 -40.99 96.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.68 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.5 mt -62.82 -40.35 97.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.792 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -60.61 -41.49 94.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.737 -179.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -148.18 141.74 25.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.63 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -95.86 147.11 24.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.561 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -120.86 157.23 30.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.433 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -56.84 -40.52 76.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.737 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -84.25 145.57 28.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.493 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.535 -179.834 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.2 mtm . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.9 t -110.52 134.22 53.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.253 -0.431 . . . . 0.0 109.993 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.34 149.61 50.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.541 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.73 151.05 34.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.5 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 74.8 m -63.71 119.71 10.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.617 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.73 -34.59 45.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.46 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.05 -39.24 81.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.664 0.269 . . . . 0.0 110.931 -178.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 95.0 mmm -56.74 -47.8 79.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.908 0.385 . . . . 0.0 110.721 -179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.9 mt -56.09 -45.86 79.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.831 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.04 78.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.367 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.19 -52.86 57.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.971 0.415 . . . . 0.0 111.344 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -56.86 -46.14 81.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.014 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.99 -39.01 84.27 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.752 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -57.89 -45.2 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.48 -47.12 87.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.481 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.52 89.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.628 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.46 -42.2 91.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -58.85 -45.5 89.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.126 0.489 . . . . 0.0 110.098 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -126.22 104.85 8.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.117 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 97.1 mt -90.6 -11.86 38.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.75 15.05 15.45 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 2.9 t -107.41 94.88 12.37 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.251 -0.404 . . . . 0.0 110.376 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -48.8 -39.2 38.91 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.447 1.431 . . . . 0.0 113.37 -174.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -57.33 -49.57 75.71 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.78 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.13 98.5 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.39 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -59.06 -45.82 89.82 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.61 -47.31 73.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.422 -176.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.49 91.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.311 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -59.66 -44.29 93.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 110.931 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -57.58 -46.41 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.352 0.596 . . . . 0.0 110.111 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -58.98 -45.22 91.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.709 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.9 mt -58.35 -44.92 88.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.575 -178.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -60.79 -41.65 96.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.926 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.2 mt -63.74 -46.13 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.621 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -58.6 -41.06 84.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.986 -177.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.3 m -84.42 15.67 3.54 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 61.98 50.76 3.97 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.481 0.658 . . . . 0.0 110.769 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.323 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -39.36 91.91 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 121.15 1.233 . . . . 0.0 111.687 -175.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.93 -37.98 69.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.959 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.13 -41.97 80.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.03 0.443 . . . . 0.0 110.129 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.6 t -55.22 -43.23 69.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.153 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.41 -52.17 54.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.61 67.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 0.0 111.172 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.1 ttt85 -72.19 -53.45 12.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.604 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -56.74 -31.56 64.67 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.756 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -76.84 -13.11 60.04 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 32.9 m -83.36 107.63 10.49 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.194 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.69 -15.8 22.33 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 121.215 1.277 . . . . 0.0 113.543 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.76 77.24 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.883 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 75.2 mt -99.88 141.59 16.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 117.615 0.707 . . . . 0.0 110.34 -176.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.15 156.13 26.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.753 -176.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.5 p -141.71 137.79 31.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.478 176.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 90.1 p -123.9 163.44 35.3 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.365 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -45.99 -46.0 16.66 Favored 'Trans proline' 0 N--CA 1.498 1.775 0 C-N-CA 121.424 1.416 . . . . 0.0 112.442 178.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -58.15 -43.06 87.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.363 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.3 m -60.08 -42.12 93.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.885 0.374 . . . . 0.0 110.601 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -58.02 -44.64 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.332 -178.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.85 -45.97 88.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.151 0.5 . . . . 0.0 110.252 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 36.4 mt -58.84 -41.46 86.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.585 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -58.62 -46.29 87.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.128 0.49 . . . . 0.0 110.351 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.0 ttp -57.6 -45.18 85.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.41 -45.64 87.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.45 92.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.461 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.69 -43.33 80.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.581 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.75 -46.53 88.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.278 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -56.62 -40.36 75.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.187 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 42.3 pt -88.4 14.0 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.05 14.67 82.38 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 121.415 -0.421 . . . . 0.0 113.592 173.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 61.7 mtt85 -97.15 86.02 3.85 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 117.831 0.816 . . . . 0.0 110.334 177.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -74.12 -39.74 63.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.394 -176.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 86.1 p -56.03 -51.04 69.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.909 0.385 . . . . 0.0 110.991 -176.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -59.88 -36.88 77.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.098 -178.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.37 -48.39 81.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.991 0.424 . . . . 0.0 110.355 -178.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -55.66 -43.71 76.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.936 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.91 -48.27 80.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.963 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.45 -45.98 85.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.493 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 -52.95 -48.87 67.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.407 -179.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -55.9 -39.6 71.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.973 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -64.39 -36.73 85.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.208 179.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.9 mt -77.94 123.97 27.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.866 0.365 . . . . 0.0 110.767 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -78.73 -38.84 37.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.91 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -54.75 -39.13 67.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.133 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -74.84 130.18 38.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.47 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -114.02 132.18 56.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.505 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -61.15 -41.24 96.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.61 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -120.22 141.03 50.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.493 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.562 -179.985 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 21.7 ttt . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -102.25 132.42 48.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.018 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.73 139.29 47.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.633 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.3 t -126.87 135.18 64.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.875 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 49.9 p -67.84 154.82 40.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.555 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -70.15 -35.33 73.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.544 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.96 -42.16 89.19 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.979 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.5 mtp -60.19 -48.09 83.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.446 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.0 mt -56.54 -44.87 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.796 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -49.08 78.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.407 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.3 m -54.01 -53.02 58.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 0.0 111.244 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.2 mmt-85 -56.73 -44.38 81.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.005 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -60.55 -40.35 91.25 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.693 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -58.3 -43.95 88.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 110.373 -178.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -60.76 -47.71 85.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.56 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.35 88.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.642 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.96 -42.0 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.861 -178.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.9 ttmp? -59.65 -46.93 87.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.063 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -124.93 109.98 13.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.451 178.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.8 -11.91 26.14 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 178.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.41 14.99 13.14 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.57 94.85 17.43 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.248 178.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -49.0 -34.69 29.98 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.341 1.361 . . . . 0.0 112.867 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -57.55 -55.38 35.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.84 0.352 . . . . 0.0 110.701 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.09 81.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.577 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.5 mm-40 -59.75 -46.37 89.37 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.684 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.65 -46.77 74.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.918 0.389 . . . . 0.0 110.519 -176.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.22 -44.61 92.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.261 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -59.25 -44.71 92.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.978 0.418 . . . . 0.0 110.808 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -57.66 -46.68 83.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.286 0.565 . . . . 0.0 110.141 -178.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 34.9 mttp -58.45 -46.73 85.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.54 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.18 -44.01 87.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.603 -177.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.2 -41.3 96.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.988 -177.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.29 -46.11 85.08 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.645 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -59.39 -40.15 85.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.094 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.8 m -84.17 15.0 3.75 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 -176.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 62.6 50.52 3.49 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.475 0.655 . . . . 0.0 110.76 177.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -124.93 49.6 3.4 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.177 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.46 -40.53 83.98 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.17 1.247 . . . . 0.0 111.541 -175.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.13 -38.1 67.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.11 -179.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -68.28 -42.29 79.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.015 0.435 . . . . 0.0 110.021 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.61 -42.98 71.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.177 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 49.9 t -65.4 -51.92 58.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.572 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.5 t -54.73 -38.91 67.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.377 . . . . 0.0 111.258 -176.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -72.13 -53.07 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.539 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.69 -31.59 64.6 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -76.83 -14.52 59.9 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -81.83 107.81 9.42 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.789 -0.624 . . . . 0.0 110.232 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -57.98 -17.14 29.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 121.235 1.29 . . . . 0.0 113.51 -174.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.35 77.07 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.323 -0.465 . . . . 0.0 113.0 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.47 139.83 20.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 117.557 0.679 . . . . 0.0 110.389 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.31 156.05 16.51 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.633 0.73 . . . . 0.0 111.712 -176.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -144.21 137.83 27.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.457 176.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.3 p -126.0 163.49 39.27 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.42 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -46.04 -45.31 17.95 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.428 1.419 . . . . 0.0 112.477 178.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.23 -43.83 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.34 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.2 m -59.22 -41.61 89.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.498 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.02 -44.94 87.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.003 0.43 . . . . 0.0 110.445 -178.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.6 -45.42 89.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.164 0.507 . . . . 0.0 110.308 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.7 mt -59.22 -42.21 90.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.477 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -58.05 -45.12 87.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.201 0.524 . . . . 0.0 110.327 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.99 -46.08 85.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.393 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.24 -45.21 88.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.508 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.54 92.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.075 0.464 . . . . 0.0 110.37 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 94.1 mt -56.17 -42.72 77.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.605 -178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -59.83 -46.35 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.262 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -55.88 -41.57 74.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.156 -177.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.4 pt -88.77 14.06 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -174.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.35 20.57 79.92 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 121.38 -0.438 . . . . 0.0 113.31 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -97.12 85.92 3.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.637 0.719 . . . . 0.0 110.258 176.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -70.35 -45.04 66.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.311 -177.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.5 m -56.05 -51.02 69.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.807 0.337 . . . . 0.0 111.129 -176.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -59.29 -37.72 78.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.102 -178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.84 -48.29 81.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.037 0.446 . . . . 0.0 110.403 -178.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.4 -44.11 75.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.951 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.87 -48.4 79.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.042 -179.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.5 t -57.52 -46.23 86.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.681 0.277 . . . . 0.0 110.408 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -52.94 -48.59 67.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.526 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -55.93 -39.08 71.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.051 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -62.99 -41.75 99.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.744 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.6 mt -64.78 -37.96 89.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.207 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -59.4 -36.84 76.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.261 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -91.27 136.22 33.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.866 0.365 . . . . 0.0 110.751 -179.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -127.4 145.08 50.94 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.344 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -127.22 142.04 51.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.496 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -57.94 -41.13 82.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -95.52 131.95 41.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.565 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.566 -179.96 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.1 m -60.18 132.38 25.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.66 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.4 143.36 42.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.589 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.3 t -105.65 134.11 48.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.91 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 78.3 p -94.08 150.07 20.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.613 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -63.95 -35.94 82.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.273 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.93 -36.18 74.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.224 -179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.6 ttm -55.38 -44.63 76.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.913 0.387 . . . . 0.0 110.9 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.8 mt -55.8 -48.57 75.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.855 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -49.02 79.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -176.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.15 -53.24 53.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.009 0.433 . . . . 0.0 111.439 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -56.91 -44.52 82.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.978 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.53 -40.43 87.15 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.507 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -58.32 -45.09 88.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.873 0.368 . . . . 0.0 110.33 -178.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.36 -47.27 86.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.504 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.3 -44.59 92.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.69 -179.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -59.61 -43.2 93.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.863 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -59.3 -46.84 87.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.026 0.441 . . . . 0.0 110.029 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -124.06 108.76 12.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.386 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.43 -11.86 26.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.9 p -92.33 14.99 14.82 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 26.2 t -108.4 94.84 14.39 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 122.033 -0.417 . . . . 0.0 110.326 178.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -48.87 -34.89 29.77 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 121.345 1.363 . . . . 0.0 113.028 -175.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.94 -55.05 39.93 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.653 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.91 84.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.561 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -59.8 -45.52 92.08 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.678 -178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.57 75.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.969 0.414 . . . . 0.0 110.432 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.38 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.322 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.99 -44.9 91.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.788 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -57.8 -47.46 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -57.97 -46.27 85.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.0 mt -58.58 -44.32 89.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.562 -177.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.0 mt -60.34 -40.82 92.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.876 -177.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.86 -46.03 83.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.796 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.85 -39.74 82.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.974 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.3 m -85.33 15.15 4.56 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 62.48 50.43 3.65 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 121.459 0.647 . . . . 0.0 110.848 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.395 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -56.14 -39.18 92.87 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.305 1.337 . . . . 0.0 111.523 -176.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.63 -38.26 69.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.06 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -67.97 -42.83 80.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.019 0.438 . . . . 0.0 110.024 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.37 -42.09 65.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 55.7 t -65.84 -53.1 41.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.536 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 25.4 m -54.46 -38.04 65.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 111.24 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -72.98 -54.03 9.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.604 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -57.3 -30.3 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.784 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -76.96 -13.99 59.9 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.9 m -84.85 107.12 10.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.78 -0.628 . . . . 0.0 110.325 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -58.39 -15.18 23.28 Favored 'Trans proline' 0 N--CA 1.502 1.973 0 C-N-CA 121.219 1.28 . . . . 0.0 113.612 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.03 77.25 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.896 -177.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.4 mt -98.65 140.18 18.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 117.49 0.645 . . . . 0.0 110.355 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.64 156.14 20.72 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.544 0.688 . . . . 0.0 111.701 -176.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.0 p -147.15 137.93 23.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.33 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -123.77 165.07 25.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.422 178.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.87 -43.96 18.92 Favored 'Trans proline' 0 N--CA 1.498 1.768 0 C-N-CA 121.434 1.423 . . . . 0.0 112.516 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.81 -45.94 88.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.257 177.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 72.1 m -58.0 -40.91 81.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.959 0.409 . . . . 0.0 110.513 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.52 -45.96 87.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.986 0.422 . . . . 0.0 110.456 -177.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -58.57 -44.37 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.255 0.55 . . . . 0.0 110.171 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.86 -42.15 83.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.54 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -58.97 -46.95 86.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.344 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.27 -43.2 82.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.448 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -59.32 -49.64 77.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.317 -178.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.21 -40.93 82.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.443 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.4 mt -56.93 -43.8 81.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.916 0.389 . . . . 0.0 110.444 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.64 -44.6 93.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.198 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 53.7 mtt-85 -55.58 -42.87 75.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.196 -176.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 26.1 pt -90.1 14.08 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.82 26.25 69.74 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 121.272 -0.49 . . . . 0.0 112.985 174.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -97.06 86.03 3.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 117.315 0.557 . . . . 0.0 109.952 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.62 -50.86 61.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.317 -176.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.0 t -55.91 -51.13 68.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.807 0.337 . . . . 0.0 111.281 -175.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -59.58 -40.97 89.12 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.033 -176.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.94 -47.27 85.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.86 0.362 . . . . 0.0 110.653 -177.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -55.62 -45.63 77.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.977 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.83 -49.8 75.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.35 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.8 t -56.98 -49.7 78.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.699 -178.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 77.0 ttt-85 -54.53 -50.02 68.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.285 -177.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.0 -40.19 76.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.777 0.322 . . . . 0.0 110.854 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -60.05 -41.75 92.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.59 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.3 mt -65.94 -39.6 90.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.917 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -61.24 -46.55 89.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.74 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -150.0 162.03 41.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.637 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -110.52 129.1 55.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.429 179.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -119.12 140.59 49.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.555 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -149.82 -66.17 0.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.515 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -56.81 -40.59 76.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.773 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.535 -179.967 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 94.2 mmm . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.0 m -60.22 -39.92 82.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.827 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.4 142.86 40.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.669 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.3 t -107.87 132.81 54.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.932 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.9 t -94.03 144.06 25.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.614 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -55.28 -36.68 66.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.214 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.94 -39.61 82.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.781 0.324 . . . . 0.0 110.799 -179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 66.4 mtt -56.28 -42.59 77.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.83 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 26.7 mt -53.88 -52.19 61.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.036 0.446 . . . . 0.0 111.077 -178.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.33 -48.98 75.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.58 -175.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.2 m -53.08 -54.05 41.32 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.703 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 81.5 mtt-85 -63.57 -37.74 88.45 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.846 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -60.51 -39.93 89.59 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.485 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -59.06 -46.5 88.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.871 0.367 . . . . 0.0 110.182 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.08 -45.7 92.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.519 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.76 -46.01 90.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.676 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -58.93 -43.1 91.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.898 -177.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.63 -47.2 87.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.941 0.4 . . . . 0.0 110.115 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -120.02 105.58 11.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.316 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -92.29 -12.01 33.64 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.96 15.04 14.02 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.7 t -107.75 94.66 12.69 Favored Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 118.046 0.385 . . . . 0.0 110.296 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.89 -39.68 39.72 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.44 1.427 . . . . 0.0 113.162 -175.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -56.52 -51.31 69.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.826 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.57 -42.78 93.25 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.511 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -59.1 -45.39 90.99 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.783 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.72 -47.11 74.16 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.934 0.397 . . . . 0.0 110.527 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.1 92.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.278 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -59.83 -44.85 93.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -57.4 -46.41 83.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 110.086 -178.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -58.78 -45.86 88.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.748 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 16.6 mt -58.2 -44.82 88.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 -178.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.6 mt -60.61 -40.68 92.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.932 -176.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 16.1 mt -64.66 -46.22 83.43 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.684 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.45 -39.48 83.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.071 -177.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.8 m -86.01 16.62 4.06 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 62.36 50.57 3.71 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.495 0.665 . . . . 0.0 110.857 176.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.9 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.21 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -57.23 -40.86 79.34 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.233 1.289 . . . . 0.0 111.629 -174.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.55 -37.79 68.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.037 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.22 -42.78 79.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.078 -178.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.43 -42.89 69.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.122 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.8 t -65.52 -52.19 54.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.572 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 m -54.91 -38.85 68.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.238 -176.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.04 -53.28 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.52 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.74 -32.6 65.72 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.011 -0.276 . . . . 0.0 111.661 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.83 -12.36 59.96 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.399 0.889 . . . . 0.0 113.399 -177.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.0 m -83.72 107.63 10.9 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.146 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -57.66 -16.67 25.56 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.185 1.256 . . . . 0.0 113.489 -174.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.25 76.97 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.962 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -100.21 140.96 18.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.597 0.698 . . . . 0.0 110.342 -176.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.66 156.11 20.83 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.629 0.728 . . . . 0.0 111.741 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.52 137.91 30.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.426 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 93.7 p -124.55 163.31 37.43 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.384 177.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -45.96 -45.01 18.12 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.483 1.455 . . . . 0.0 112.458 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.33 -43.24 88.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.378 177.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 75.8 m -59.75 -41.62 91.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.989 0.423 . . . . 0.0 110.572 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.12 -45.77 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.039 0.447 . . . . 0.0 110.432 -178.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.97 -45.54 90.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.203 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 44.8 mt -58.22 -41.38 83.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -59.36 -47.37 85.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.203 0.525 . . . . 0.0 110.467 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.72 -44.5 86.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.49 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.41 -45.97 90.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.09 -44.09 91.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.947 0.404 . . . . 0.0 110.32 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 95.4 mt -56.4 -43.29 79.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.681 -178.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.68 -46.36 89.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 8.7 mtp-105 -56.88 -40.92 77.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.271 -177.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 39.0 pt -87.57 14.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -175.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.61 20.25 79.79 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 119.859 -0.412 . . . . 0.0 113.331 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -97.14 85.98 3.84 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 117.734 0.767 . . . . 0.0 110.011 176.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -66.09 -47.21 75.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.496 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 84.3 p -55.97 -51.06 69.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.78 0.324 . . . . 0.0 111.272 -175.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -60.85 -39.43 89.09 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.911 -0.316 . . . . 0.0 111.084 -176.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.25 -47.52 84.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.828 0.347 . . . . 0.0 110.621 -177.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -55.76 -44.98 78.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.959 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.08 77.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.217 -178.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 49.3 t -57.68 -49.4 80.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.685 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -54.14 -47.78 71.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.428 -177.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -55.99 -38.64 70.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.039 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -62.6 -39.43 93.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.868 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.5 mt -64.59 -43.97 92.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.911 -178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -140.05 143.9 36.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.826 0.346 . . . . 0.0 110.77 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -120.21 143.77 48.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.492 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -119.61 145.86 46.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.428 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -98.94 107.29 19.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.547 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -60.54 -41.1 93.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.661 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 79.3 m80 -132.21 159.0 40.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.502 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.575 -179.981 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.1 mtm . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -108.07 133.0 54.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.019 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -84.0 140.07 32.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.582 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.2 t -104.54 134.17 46.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.95 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.1 m -94.03 146.31 24.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.655 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -61.33 -37.37 83.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.177 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.97 88.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.801 0.334 . . . . 0.0 110.764 -178.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.3 ttm -56.71 -47.54 79.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.931 0.396 . . . . 0.0 110.719 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.81 -46.39 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.93 79.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.392 -176.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.4 -52.83 58.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.019 0.438 . . . . 0.0 111.397 -178.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -56.71 -45.66 81.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.059 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -60.25 -39.38 86.57 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.705 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -57.74 -44.36 85.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.337 -178.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -61.04 -48.66 80.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.496 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.57 -42.81 88.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.686 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -59.11 -43.39 91.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 -178.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.4 mttp -58.91 -46.94 86.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.117 0.484 . . . . 0.0 110.076 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -125.93 108.8 11.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.473 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.39 -11.96 26.81 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 177.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.61 14.73 14.23 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.1 t -107.87 94.82 13.23 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.066 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -48.78 -34.77 28.81 Favored 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.396 1.397 . . . . 0.0 113.114 -174.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.76 -55.41 35.18 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.652 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.67 85.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.555 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -59.28 -45.56 90.92 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.772 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.74 -49.19 71.42 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.461 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.75 89.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.37 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -59.28 -44.36 92.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 -179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -56.76 -43.98 81.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.349 0.595 . . . . 0.0 110.178 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -58.19 -48.21 81.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.938 -178.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 44.3 mt -57.0 -43.88 82.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.612 -176.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 22.3 mt -61.22 -41.02 96.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.956 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.0 mt -64.53 -46.05 84.56 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.511 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.72 -40.49 83.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.9 m -85.44 15.98 4.09 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 m120 61.8 51.18 3.94 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.506 0.669 . . . . 0.0 110.718 177.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -124.87 49.88 3.59 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.149 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.44 -39.81 88.8 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.108 1.205 . . . . 0.0 111.58 -175.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.92 -38.15 69.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.994 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -68.18 -42.54 79.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.04 0.448 . . . . 0.0 110.086 -178.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.75 -42.86 71.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.151 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.71 -52.12 54.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.647 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -55.06 -38.69 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.82 0.343 . . . . 0.0 111.115 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.03 -53.01 14.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.495 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.61 -32.51 65.34 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.726 -176.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -76.98 -12.18 59.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -177.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.7 m -84.01 107.87 12.06 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.226 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -57.62 -16.3 23.84 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 121.263 1.309 . . . . 0.0 113.542 -174.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -22.66 77.19 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 121.228 -0.51 . . . . 0.0 112.902 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.5 mt -100.89 140.32 20.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.574 0.687 . . . . 0.0 110.281 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.21 156.16 22.68 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.69 0.757 . . . . 0.0 111.578 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.5 p -143.03 137.81 29.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.411 175.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -126.1 165.09 29.55 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.463 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.88 -44.12 18.8 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 121.486 1.457 . . . . 0.0 112.424 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.6 -45.35 89.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.903 0.382 . . . . 0.0 110.288 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.4 m -58.78 -41.01 85.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.56 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.18 -45.47 87.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.435 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -59.1 -46.36 88.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.5 mt -58.1 -42.25 85.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.519 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.91 -45.99 90.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.659 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.4 ttp -57.72 -45.44 85.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.411 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -58.73 -46.0 88.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.41 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.19 90.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.09 0.472 . . . . 0.0 110.364 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.9 mt -56.58 -44.19 80.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.655 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -58.95 -46.11 88.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.4 mtp180 -56.62 -41.02 76.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.226 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -89.23 14.05 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -175.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.63 19.78 79.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 121.342 -0.456 . . . . 0.0 113.399 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 -97.17 91.87 5.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 117.598 0.699 . . . . 0.0 110.192 176.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -75.43 -40.26 57.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.366 -176.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.0 m -55.96 -51.07 69.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.752 0.311 . . . . 0.0 111.168 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.45 -38.83 85.39 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.966 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.7 -47.5 85.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.879 0.371 . . . . 0.0 110.495 -177.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -55.88 -44.83 78.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.837 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.72 -48.74 78.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.269 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.0 t -57.72 -47.27 86.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.544 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -53.07 -49.71 65.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.652 0.263 . . . . 0.0 111.555 -178.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -56.01 -39.29 71.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.956 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -63.93 -40.25 96.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.862 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 80.2 mt -66.28 -37.99 86.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.148 -178.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -64.35 -46.22 84.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.943 -178.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -146.82 164.61 32.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.825 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -127.82 172.08 11.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.397 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -100.33 129.51 46.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.607 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -58.05 -42.4 85.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.6 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -138.75 143.66 39.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.563 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 . . . . . 0 C--O 1.219 -0.502 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.536 179.904 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 94.3 mmm . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.5 m -132.54 153.04 37.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.526 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.77 141.26 44.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.637 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -108.02 134.97 48.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.933 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 p -94.03 151.2 19.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.697 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -72.01 -27.09 62.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.198 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.93 -39.14 80.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.627 0.251 . . . . 0.0 110.906 -177.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.6 mtp -56.25 -47.76 77.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.953 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.1 mt -56.04 -47.34 78.06 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.956 -178.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.18 78.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.386 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.88 -52.43 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 111.243 -178.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -56.76 -45.7 81.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.62 -40.06 86.31 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.556 -178.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.33 -45.66 87.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.882 0.372 . . . . 0.0 110.401 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -60.25 -46.18 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.453 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.67 84.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.659 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.48 -40.51 87.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.939 -177.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.36 -46.8 87.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.052 0.453 . . . . 0.0 109.976 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -125.48 108.08 11.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.3 177.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.9 mt -93.39 -11.81 31.36 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.43 14.96 15.1 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -108.36 94.82 14.26 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 118.057 0.39 . . . . 0.0 110.291 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -48.83 -34.45 28.18 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 121.417 1.411 . . . . 0.0 113.105 -175.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -58.32 -55.2 38.06 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.629 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.78 -41.67 82.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.641 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.4 mm-40 -59.8 -46.38 89.4 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.419 -0.512 . . . . 0.0 109.658 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.66 -45.52 73.87 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.98 0.419 . . . . 0.0 110.531 -175.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.49 92.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.204 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -58.99 -44.26 91.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.001 0.429 . . . . 0.0 110.8 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -57.47 -46.79 83.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 0.0 110.063 -178.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -58.19 -46.65 85.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.521 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.28 -43.76 88.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 -177.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.3 mt -61.45 -41.05 96.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.983 -176.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 19.6 mt -64.92 -46.03 83.35 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.716 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.4 -39.76 84.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.133 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.5 m -85.27 16.32 3.72 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -176.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 62.16 50.66 3.85 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.488 0.661 . . . . 0.0 110.731 176.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -124.89 49.57 3.35 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.375 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.04 -40.43 83.87 Favored 'Trans proline' 0 N--CA 1.497 1.687 0 C-N-CA 121.168 1.245 . . . . 0.0 111.691 -175.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.66 -37.41 68.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.024 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.81 -42.1 77.74 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.974 0.416 . . . . 0.0 110.135 -178.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.13 -41.82 61.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.269 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 62.0 t -65.26 -53.23 42.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.514 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 m -54.45 -38.42 66.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 111.238 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.2 ttt85 -73.08 -53.27 11.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.535 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -57.37 -30.33 64.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.733 -176.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.79 -12.79 60.03 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.4 m -85.66 106.98 10.81 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.69 -0.671 . . . . 0.0 110.241 179.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.43 -14.17 19.58 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.209 1.273 . . . . 0.0 113.613 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.76 76.83 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.772 -177.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -98.37 140.73 17.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 117.53 0.665 . . . . 0.0 110.377 -176.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.08 156.06 22.47 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.619 0.723 . . . . 0.0 111.719 -177.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -144.88 137.86 26.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.505 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.06 165.06 29.66 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.386 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.93 -44.63 18.43 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.476 1.451 . . . . 0.0 112.476 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.34 -44.8 88.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.948 0.404 . . . . 0.0 110.3 177.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 74.9 m -58.79 -42.15 88.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.476 -179.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.1 mtp -58.82 -45.09 90.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.546 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -58.56 -45.48 88.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.206 0.526 . . . . 0.0 110.19 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 35.1 mt -58.16 -43.19 87.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.284 0.564 . . . . 0.0 110.288 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -57.9 -45.31 86.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.362 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -57.72 -45.16 86.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.456 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.63 -46.12 87.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.463 -178.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.64 91.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 93.3 mt -56.36 -43.58 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.581 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -59.71 -46.1 90.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.239 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -56.34 -40.89 75.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.222 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 40.8 pt -88.28 13.99 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -174.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.58 19.79 78.93 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.382 -0.437 . . . . 0.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -97.08 85.97 3.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.645 0.723 . . . . 0.0 110.124 176.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -69.99 -46.95 64.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.396 -176.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.1 m -55.96 -51.06 69.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.769 0.319 . . . . 0.0 111.173 -175.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.93 -40.5 84.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.933 -177.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.24 -47.51 84.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.873 0.368 . . . . 0.0 110.747 -177.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -55.46 -45.55 76.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.001 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.93 -49.89 75.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.26 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 53.8 t -57.02 -49.35 79.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 C-N-CA 120.961 -0.295 . . . . 0.0 110.641 -178.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -54.32 -50.04 68.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.31 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -57.36 -40.43 78.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.791 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -61.42 -37.47 83.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.192 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 25.1 mt -73.84 144.34 45.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.868 -178.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -121.48 145.86 47.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.363 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -56.9 110.57 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.732 -179.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 25.9 m80 -144.03 154.6 43.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.61 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -105.97 117.66 34.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.478 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -81.47 -41.71 21.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.623 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -102.95 139.04 39.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.577 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.597 179.783 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 54.5 ttp . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.7 p -135.2 141.87 41.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.384 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.33 142.23 54.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.58 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.5 m -132.73 151.01 33.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.407 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.9 t -82.06 125.3 30.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.653 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -61.06 -32.29 71.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.746 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.89 77.64 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.133 -177.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.8 mtp -55.71 -50.53 70.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.948 0.404 . . . . 0.0 111.045 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.5 mt -55.57 -47.16 76.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.009 -178.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.69 -49.06 79.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.529 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.6 m -54.08 -52.69 60.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.871 0.367 . . . . 0.0 111.265 -178.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 33.6 mmt180 -57.28 -45.16 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.885 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -59.87 -40.2 87.82 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.548 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -58.61 -45.58 88.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.817 0.341 . . . . 0.0 110.308 -178.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.35 -46.18 90.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.536 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.62 -48.05 83.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.5 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.27 -40.77 87.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.95 -177.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.4 tttp -59.29 -46.28 88.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.081 0.467 . . . . 0.0 110.008 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -126.11 108.66 11.55 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.317 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -93.47 -11.94 30.87 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.31 15.01 14.73 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 17.7 t -108.51 94.72 14.39 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.255 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -48.73 -34.95 28.97 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 121.379 1.386 . . . . 0.0 113.067 -175.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.77 -55.06 39.74 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.634 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.65 83.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.638 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -59.47 -45.9 90.32 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.74 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.46 -47.2 73.19 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.127 0.489 . . . . 0.0 110.424 -176.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -45.07 92.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.265 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -58.64 -44.27 90.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.808 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -57.58 -46.75 83.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.272 0.558 . . . . 0.0 110.103 -178.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 29.9 mttp -58.51 -45.93 87.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.683 -178.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.47 -44.37 89.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.529 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.87 -41.28 95.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.994 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.68 -46.14 83.67 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.714 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.94 -40.02 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.071 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 68.1 m -85.75 16.57 3.91 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 61.76 51.06 4.02 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.42 0.628 . . . . 0.0 110.697 176.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -124.86 49.6 3.36 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.272 177.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -56.19 -40.65 83.47 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.225 1.283 . . . . 0.0 111.579 -175.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.46 -38.03 68.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.09 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.63 -41.78 78.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 110.188 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.3 t -55.44 -42.39 67.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.235 179.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 52.6 t -65.96 -52.49 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.7 m -54.63 -38.33 66.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.801 0.334 . . . . 0.0 111.212 -176.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -73.06 -53.35 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.516 -178.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -56.78 -31.58 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.91 -12.91 60.02 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.5 m -84.69 107.45 11.38 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-O 118.73 -0.653 . . . . 0.0 110.24 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.83 -15.83 23.19 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 121.238 1.292 . . . . 0.0 113.554 -174.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.08 -22.16 77.18 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.868 -177.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -100.24 139.44 21.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 117.646 0.723 . . . . 0.0 110.266 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.09 156.07 18.94 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.571 0.701 . . . . 0.0 111.861 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.7 p -144.77 137.89 26.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.394 176.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -126.03 164.99 30.02 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.547 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.86 -44.84 17.94 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.506 1.471 . . . . 0.0 112.533 179.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.29 -44.03 88.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.981 0.419 . . . . 0.0 110.376 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.7 m -59.17 -41.76 89.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.489 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.33 -45.67 87.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.412 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.53 -45.4 88.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.127 0.489 . . . . 0.0 110.238 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 45.0 mt -58.41 -42.67 87.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.347 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -58.12 -45.69 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.124 0.488 . . . . 0.0 110.354 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.06 -44.35 82.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.497 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -58.99 -49.06 79.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.229 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.56 83.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.566 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.81 -43.23 80.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.958 0.408 . . . . 0.0 110.403 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.89 -44.71 94.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.281 177.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -55.48 -43.09 75.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.068 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 31.4 pt -89.24 14.14 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -174.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.93 25.59 68.92 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 121.238 -0.506 . . . . 0.0 113.116 173.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -97.06 86.08 3.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 117.353 0.577 . . . . 0.0 110.05 175.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -67.17 -52.0 46.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.377 -176.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.4 m -55.92 -51.08 68.9 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.258 -175.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.83 -41.26 90.93 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.957 -177.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.42 -46.73 87.22 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.699 -176.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -56.01 -45.89 78.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.849 0.357 . . . . 0.0 110.937 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.87 -49.68 75.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.323 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 46.2 t -60.58 -47.51 92.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.71 0.291 . . . . 0.0 110.748 -178.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -53.74 -47.1 70.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.405 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -55.91 -39.21 71.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.037 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -60.19 -41.34 92.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 110.719 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 79.3 mt -69.68 -35.37 75.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.506 -179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -54.37 -37.54 65.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.3 -178.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -62.01 134.04 56.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.78 0.324 . . . . 0.0 110.507 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -69.04 160.37 31.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.526 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 33.4 t60 -90.36 123.73 34.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.474 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -56.67 -40.53 75.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.823 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -84.39 136.1 34.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.652 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 . . . . . 0 C--O 1.219 -0.538 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.511 179.937 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -108.05 127.82 63.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.022 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.93 146.54 27.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.53 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.9 t -101.31 126.5 55.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.961 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 53.4 p -93.99 159.23 15.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.624 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -57.53 -36.24 71.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.23 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.01 -40.72 85.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.75 0.31 . . . . 0.0 110.766 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.6 mtp -56.95 -45.81 82.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.873 0.368 . . . . 0.0 110.648 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.53 -46.48 80.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.3 -49.02 79.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.296 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.67 -53.33 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.357 -178.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -56.72 -43.75 80.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.26 -40.44 90.33 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.61 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -57.99 -43.76 86.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.898 0.38 . . . . 0.0 110.398 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -60.59 -47.81 84.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.482 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.85 90.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.671 -178.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.26 -42.32 90.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.863 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.0 tttp -58.95 -46.02 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.06 0.457 . . . . 0.0 110.036 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -127.68 110.39 12.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.381 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.8 mt -95.3 -11.91 27.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.08 15.01 14.3 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.9 t -108.67 94.87 15.02 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 119.195 -0.431 . . . . 0.0 110.295 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.77 -34.4 27.65 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.402 1.401 . . . . 0.0 113.038 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.79 -55.67 31.89 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.683 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.7 83.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.579 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -59.68 -45.8 90.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.739 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.64 75.08 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.963 0.411 . . . . 0.0 110.481 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.39 -44.55 92.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.285 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.04 -44.87 91.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.025 0.44 . . . . 0.0 110.926 -178.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -57.7 -46.66 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.341 0.591 . . . . 0.0 110.099 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.7 mttp -58.48 -45.96 87.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.4 mt -58.21 -44.38 88.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 -178.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 20.0 mt -60.86 -40.88 94.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.924 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.2 mt -64.42 -46.1 84.69 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.67 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -58.92 -39.93 83.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.746 0.308 . . . . 0.0 111.08 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.7 m -85.05 14.91 4.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -176.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.8 t30 62.53 50.56 3.55 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.499 0.666 . . . . 0.0 110.808 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.204 177.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.96 -39.12 93.77 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 121.159 1.239 . . . . 0.0 111.605 -175.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -55.88 -38.07 69.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.05 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -68.41 -42.18 79.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.938 0.399 . . . . 0.0 110.059 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.5 t -55.77 -42.89 71.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.187 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.9 t -65.83 -51.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.617 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.1 t -54.84 -38.7 67.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.931 0.396 . . . . 0.0 111.183 -176.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -72.42 -53.12 13.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.551 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -56.55 -32.15 64.85 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.683 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.88 -11.91 59.89 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -85.28 107.22 11.24 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.292 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.98 -15.22 21.47 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 121.298 1.332 . . . . 0.0 113.502 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.88 77.28 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 121.279 -0.486 . . . . 0.0 112.858 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.3 mt -99.83 141.14 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.514 0.657 . . . . 0.0 110.282 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.58 156.07 20.65 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.624 0.726 . . . . 0.0 111.689 -176.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -142.8 137.91 30.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.454 176.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 96.7 p -125.97 163.34 40.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.406 177.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.13 -45.22 18.43 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 121.459 1.439 . . . . 0.0 112.454 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.44 -43.48 88.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.251 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.1 m -59.69 -41.36 90.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.562 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.1 -45.16 87.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.999 0.428 . . . . 0.0 110.429 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.81 -45.27 90.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.224 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.7 mt -58.97 -41.77 88.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.562 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -58.8 -45.99 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.184 0.516 . . . . 0.0 110.347 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 64.1 ttp -57.68 -46.01 84.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.39 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.41 -45.23 88.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.503 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.4 -44.49 92.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.436 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 93.4 mt -56.09 -42.31 76.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.694 -178.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -60.24 -46.17 90.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.231 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.3 mtp85 -56.43 -41.39 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.216 -177.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 37.2 pt -88.18 14.02 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -175.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.36 24.67 74.95 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 121.498 -0.382 . . . . 0.0 113.06 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 45.1 mtp85 -97.12 86.99 4.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 117.485 0.642 . . . . 0.0 110.056 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -65.89 -45.59 81.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.641 -175.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 21.8 m -55.93 -51.14 68.69 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.339 -174.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -62.8 -38.27 90.03 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.101 -176.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.96 -46.96 87.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.876 0.37 . . . . 0.0 110.445 -178.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -55.87 -45.05 78.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.918 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.85 -48.0 81.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.029 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 48.8 t -58.31 -45.18 89.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.522 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -53.01 -49.2 66.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.674 0.273 . . . . 0.0 111.498 -179.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -55.84 -39.92 72.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.957 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -65.33 -36.67 84.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.178 178.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 41.5 mt -96.92 108.81 21.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 0.0 110.72 -177.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -146.18 -71.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.287 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -150.08 -65.56 0.21 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.878 0.37 . . . . 0.0 110.297 178.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -138.42 168.95 18.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.212 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -56.83 146.42 26.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.795 0.331 . . . . 0.0 110.697 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -56.85 -40.81 76.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.741 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -86.61 131.01 34.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.587 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.976 -1.012 . . . . 0.0 110.535 -179.832 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 97.5 mmm . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 27.4 m -79.29 -37.29 18.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.139 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.76 129.95 34.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 110.801 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.2 t -134.4 137.78 50.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.908 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 44.9 t -79.31 136.63 37.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.0 p-80 -67.56 -35.46 79.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.391 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.23 87.1 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.746 0.307 . . . . 0.0 110.692 -178.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.5 mtp -56.46 -44.47 80.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.773 0.32 . . . . 0.0 110.758 -179.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.7 mt -53.53 -52.11 60.72 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.116 -178.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.46 -49.01 73.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.716 -174.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -54.17 -54.08 44.7 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.583 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 77.8 mtt-85 -63.93 -37.05 85.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.942 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -61.26 -40.14 92.97 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.468 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -59.31 -45.58 90.92 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.19 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -59.95 -45.2 93.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.542 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.32 -47.7 84.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.62 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -58.96 -41.55 87.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.969 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -59.76 -47.16 86.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.073 0.464 . . . . 0.0 110.024 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -125.74 111.12 14.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.366 177.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.7 mt -94.64 -11.99 28.24 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -91.71 15.06 13.52 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.3 t -107.81 94.89 13.23 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.295 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -48.92 -37.22 36.28 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.363 1.375 . . . . 0.0 113.113 -174.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.27 -53.79 54.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 0.0 110.675 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.19 -42.68 86.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.598 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.46 -45.15 92.44 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.77 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -47.08 73.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.937 0.398 . . . . 0.0 110.477 -176.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.02 -44.54 91.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.338 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.71 -43.66 94.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.433 . . . . 0.0 110.863 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -57.64 -46.49 84.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.321 0.581 . . . . 0.0 110.018 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.9 mttt -58.89 -42.95 90.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.758 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 14.1 mt -58.26 -48.15 81.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.0 110.35 -179.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.39 -40.19 85.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 23.9 mt -65.37 -46.13 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.832 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -59.02 -39.14 81.0 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.969 -177.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.1 m -87.61 17.34 4.71 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.2 t30 62.15 50.56 3.91 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.431 0.634 . . . . 0.0 110.883 176.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.86 49.45 3.23 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.544 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.34 -39.69 89.65 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 121.236 1.291 . . . . 0.0 111.707 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.36 -38.46 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.016 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -67.98 -41.97 81.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.412 . . . . 0.0 110.126 -178.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.95 -43.53 75.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.185 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.2 t -65.1 -51.99 58.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.539 -177.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -55.29 -39.41 69.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.945 0.403 . . . . 0.0 111.135 -176.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -71.66 -51.7 21.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.573 -178.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -57.14 -33.06 67.0 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.649 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -76.96 -10.2 59.21 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.6 m -84.2 107.54 11.17 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.708 -0.663 . . . . 0.0 110.223 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.74 -17.39 29.12 Favored 'Trans proline' 0 N--CA 1.501 1.956 0 C-N-CA 121.237 1.291 . . . . 0.0 113.478 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.91 -21.65 76.8 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.01 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.2 mt -101.08 140.3 20.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 117.58 0.69 . . . . 0.0 110.355 -176.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.61 156.11 24.19 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.767 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -142.8 137.85 29.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.381 176.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.5 p -125.96 165.11 29.17 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.457 177.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.96 -44.58 18.63 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 121.416 1.411 . . . . 0.0 112.482 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.51 -44.36 89.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.273 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.43 -41.91 90.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.401 . . . . 0.0 110.523 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.15 -45.35 87.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.358 -177.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -58.8 -45.9 88.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.206 0.527 . . . . 0.0 110.235 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 34.5 mt -59.09 -41.33 87.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.556 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -58.16 -46.56 85.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.178 0.513 . . . . 0.0 110.149 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.8 ttp -57.72 -43.99 85.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.496 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.78 -46.58 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.553 -178.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.36 91.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.007 0.432 . . . . 0.0 110.352 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 95.7 mt -56.78 -43.16 80.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.565 -178.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -46.15 89.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.178 179.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.6 mtp85 -56.19 -42.35 77.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.206 -176.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 37.7 pt -89.47 14.07 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.92 23.13 70.03 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.282 172.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -97.12 88.13 4.4 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 117.516 0.658 . . . . 0.0 110.251 175.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -70.5 -49.01 52.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.32 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 85.2 p -55.95 -51.1 68.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.745 0.307 . . . . 0.0 111.207 -176.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -59.48 -39.0 82.28 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.904 -0.319 . . . . 0.0 110.97 -177.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.34 -47.92 82.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.894 0.378 . . . . 0.0 110.537 -177.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -55.62 -44.78 77.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.896 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.87 -49.91 75.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.247 -179.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.79 -48.11 84.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.984 -0.287 . . . . 0.0 110.605 -178.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -53.54 -49.07 68.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.325 -178.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -56.02 -39.25 71.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.982 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -62.41 -38.78 91.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.98 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 79.9 mt -58.59 -34.15 70.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.554 -179.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -54.76 -38.09 66.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.645 0.26 . . . . 0.0 111.239 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -139.32 132.3 29.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.789 0.328 . . . . 0.0 110.814 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -134.82 154.55 51.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.542 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -106.34 130.24 54.21 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -96.84 -68.56 0.79 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.887 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -110.0 141.13 43.21 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.727 -178.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 C--O 1.219 -0.508 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.599 179.615 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.7 ttm . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -121.42 135.8 60.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.959 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.2 144.46 56.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.665 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.6 p -135.81 144.89 32.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.221 179.863 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.0 t -94.04 143.57 26.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.633 -179.605 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -54.62 -35.36 63.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.373 179.861 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.94 77.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.671 0.272 . . . . 0.0 111.033 -178.742 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.2 mmm -56.32 -43.99 79.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.851 0.357 . . . . 0.0 110.714 -179.437 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.4 mt -56.2 -48.74 75.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.858 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.64 -49.04 79.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.289 -176.646 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.08 -53.49 49.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.39 -178.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.7 -44.74 81.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -178.825 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.14 -39.54 86.69 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.662 -179.18 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -58.06 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.94 0.4 . . . . 0.0 110.318 -178.774 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.4 -47.42 86.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.435 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.09 91.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.668 -178.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -59.35 -43.18 92.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.842 -178.371 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -59.11 -46.32 88.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.09 0.472 . . . . 0.0 110.095 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -125.72 108.88 11.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.33 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.16 -11.88 27.37 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 178.54 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.82 14.95 14.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.2 t -108.25 94.73 13.87 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.206 -0.426 . . . . 0.0 110.285 178.485 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -48.76 -34.53 27.98 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.411 1.407 . . . . 0.0 113.053 -175.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -58.03 -55.43 35.06 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.593 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.83 83.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.574 -179.042 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -59.81 -45.89 90.92 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.665 -178.924 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.53 74.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.003 0.43 . . . . 0.0 110.544 -176.297 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.82 92.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.307 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -59.17 -44.35 92.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.928 0.394 . . . . 0.0 110.834 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -57.73 -46.61 84.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.132 -178.765 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -58.55 -45.93 87.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.676 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.3 -44.51 88.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.542 -178.039 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.6 mt -60.96 -41.06 95.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.859 -176.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 12.6 mt -63.93 -46.11 86.22 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.611 179.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.79 -40.56 84.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.029 -177.677 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -84.85 15.99 3.62 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 61.75 50.86 4.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.792 177.01 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.9 49.15 3.0 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.275 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.51 -39.75 86.19 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 121.111 1.207 . . . . 0.0 111.765 -174.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.6 -37.94 68.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.0 -179.65 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.9 79.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.001 0.429 . . . . 0.0 110.176 -179.075 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.36 -42.72 68.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.247 179.249 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 44.8 t -65.57 -52.23 53.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.5 -177.618 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.1 m -54.87 -39.06 68.27 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.883 0.373 . . . . 0.0 111.191 -176.526 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -71.86 -52.72 16.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.592 -178.928 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.29 -32.91 65.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -176.228 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -76.81 -12.21 59.94 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.009 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 27.0 m -83.44 107.82 11.21 Favored Pre-proline 0 CA--C 1.535 0.385 0 CA-C-O 118.669 -0.681 . . . . 0.0 110.338 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.61 -16.62 25.05 Favored 'Trans proline' 0 N--CA 1.501 1.947 0 C-N-CA 121.249 1.299 . . . . 0.0 113.516 -174.689 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.03 -22.9 77.34 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.842 -177.1 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.9 140.77 18.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.567 0.683 . . . . 0.0 110.28 -176.305 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.51 156.05 20.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.569 0.699 . . . . 0.0 111.749 -176.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.0 p -142.23 137.89 31.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.405 176.53 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.9 p -126.02 163.23 40.95 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.522 177.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.08 -45.26 18.18 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.43 1.42 . . . . 0.0 112.472 178.728 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.33 -43.31 88.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.308 177.964 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.6 m -59.81 -41.51 91.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.554 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.07 -45.21 87.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.372 -178.28 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.73 -45.45 89.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.13 0.491 . . . . 0.0 110.207 179.725 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 40.3 mt -59.03 -40.94 86.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.712 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -58.78 -47.24 85.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.127 0.489 . . . . 0.0 110.256 179.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.2 ttp -57.95 -44.8 87.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.42 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.45 -45.15 89.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.538 -178.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.54 93.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.049 0.452 . . . . 0.0 110.496 -178.241 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.2 mt -56.56 -41.96 77.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.589 -178.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -60.7 -45.78 92.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.445 178.687 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 -56.19 -41.03 74.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.178 -177.111 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 36.0 pt -86.48 14.03 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -175.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.54 20.0 79.77 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 121.502 -0.38 . . . . 0.0 113.182 174.504 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -97.16 86.01 3.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.696 0.748 . . . . 0.0 109.848 177.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -71.81 -47.53 52.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.843 -174.364 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.0 t -55.86 -51.18 68.45 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.499 -173.734 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -64.84 -37.16 86.68 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.986 -176.861 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -60.61 -46.95 88.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.94 0.4 . . . . 0.0 110.3 -178.589 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -56.53 -45.13 81.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.808 179.686 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.83 -48.13 80.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.171 -178.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 47.2 t -59.81 -46.95 93.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.658 0.266 . . . . 0.0 110.662 -179.266 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -53.1 -44.58 67.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.413 -178.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -55.98 -39.41 71.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.899 179.226 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -62.53 -39.87 94.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.76 179.212 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.87 147.52 28.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.52 179.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -126.45 157.69 37.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.586 -179.71 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -108.19 143.11 37.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.55 179.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -111.8 136.71 50.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.583 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -109.17 142.31 40.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.492 179.857 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -56.89 -41.24 77.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.684 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -107.28 141.51 38.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.492 -179.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.6 179.975 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 55.2 ttp . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.5 t -64.91 132.54 30.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.118 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.05 148.86 46.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.577 -179.866 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -95.87 129.24 46.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.95 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 95.6 p -94.01 136.81 33.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.723 -179.24 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 27.5 p-80 -77.72 -20.18 53.96 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 178.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.97 -34.7 72.1 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 122.322 -0.236 . . . . 0.0 111.452 -177.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 72.8 mtm -54.93 -51.37 66.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.789 0.328 . . . . 0.0 111.198 -178.017 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.4 -48.01 75.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.96 -178.634 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.04 79.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.372 -176.343 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.33 -51.79 61.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.907 0.384 . . . . 0.0 111.344 -178.217 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -56.8 -46.11 81.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.002 -179.037 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -59.83 -40.01 87.04 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.582 -179.033 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.34 -45.78 87.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.323 -178.482 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -60.29 -46.66 89.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.563 -178.681 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.05 89.52 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 -179.511 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 56.2 t-20 -59.05 -43.41 91.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.026 -177.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -60.07 -47.31 86.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.951 0.405 . . . . 0.0 110.133 -179.481 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -121.92 108.85 13.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.383 178.151 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.4 mt -95.65 -11.88 26.47 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 178.429 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 80.0 p -92.36 15.07 14.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.152 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.9 t -109.09 94.79 15.84 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.208 178.249 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -48.87 -35.19 30.59 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.411 1.407 . . . . 0.0 112.92 -175.437 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -57.77 -54.93 41.33 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.667 -179.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.7 81.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.576 -179.02 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -59.82 -47.05 87.29 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.689 -179.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.43 -46.34 73.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.883 0.373 . . . . 0.0 110.583 -175.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.53 91.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.245 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -58.63 -44.57 90.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.854 -179.15 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -57.71 -46.76 83.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.327 0.584 . . . . 0.0 110.114 -178.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -58.46 -46.41 86.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.678 -178.136 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 44.6 mt -58.67 -44.34 90.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.544 -178.088 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.4 mt -61.4 -40.68 95.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.946 -176.643 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 18.6 mt -64.92 -46.14 82.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.655 179.879 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.45 -39.71 84.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.693 0.283 . . . . 0.0 111.101 -177.792 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.3 m -85.64 16.42 3.94 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -176.774 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 58.3 t30 62.18 50.85 3.75 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.464 0.65 . . . . 0.0 110.848 176.705 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.95 48.68 2.73 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.397 177.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -57.3 -39.38 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.133 1.222 . . . . 0.0 111.694 -174.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.95 -38.18 69.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.021 -179.12 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -69.38 -41.61 76.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.905 0.383 . . . . 0.0 110.016 -179.047 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.6 t -55.34 -42.82 68.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.153 179.179 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -66.4 -52.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.646 -177.541 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 85.0 p -54.64 -37.7 65.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.832 0.349 . . . . 0.0 111.205 -176.666 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.92 -54.02 9.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.54 -179.077 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.64 -30.91 63.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.838 0.311 . . . . 0.0 111.838 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.81 -16.03 59.56 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 9.2 m -81.25 107.91 9.11 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.218 -179.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -57.62 -16.39 24.2 Favored 'Trans proline' 0 N--CA 1.502 1.994 0 C-N-CA 121.13 1.22 . . . . 0.0 113.501 -174.384 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -23.4 77.06 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 121.296 -0.478 . . . . 0.0 112.913 -177.074 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.23 140.73 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 117.51 0.655 . . . . 0.0 110.362 -176.076 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.48 156.05 20.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.637 0.732 . . . . 0.0 111.8 -176.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.1 p -144.15 137.89 27.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.418 176.237 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.2 p -125.55 163.53 38.17 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.259 177.671 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -45.97 -45.11 18.03 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 121.527 1.485 . . . . 0.0 112.456 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.34 -44.12 88.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.271 177.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.53 -41.23 89.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.545 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.04 -45.22 87.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.952 0.406 . . . . 0.0 110.427 -178.069 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -58.73 -45.79 88.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.138 0.494 . . . . 0.0 110.223 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.6 mt -58.72 -41.64 86.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.536 -179.838 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -58.63 -46.06 87.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.162 0.506 . . . . 0.0 110.375 179.661 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -58.08 -44.38 87.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.453 -178.995 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.74 -47.01 86.09 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.42 -177.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.72 90.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.063 0.458 . . . . 0.0 110.374 -178.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 93.7 mt -56.33 -43.47 79.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.594 -178.655 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.48 -46.47 88.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.228 179.715 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -56.73 -40.79 76.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.263 -176.896 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 41.0 pt -88.5 14.08 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.118 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.71 19.35 79.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.423 -0.418 . . . . 0.0 113.371 174.422 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 -97.14 86.08 3.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 117.659 0.73 . . . . 0.0 110.17 176.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 46.4 p-80 -70.83 -45.81 63.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.364 -177.097 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.0 m -55.95 -51.08 68.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.893 0.378 . . . . 0.0 111.17 -176.518 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -59.15 -38.98 81.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.981 -177.725 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.21 -47.97 82.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.895 0.379 . . . . 0.0 110.539 -177.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -55.35 -44.99 76.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.966 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.86 -49.41 76.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.242 -179.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.7 t -57.26 -48.14 82.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.651 -178.769 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 58.8 ttt85 -53.51 -50.06 66.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.348 -178.296 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -57.64 -40.52 79.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.711 179.185 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -56.97 -39.33 74.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.937 -179.691 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 83.4 mt -56.18 -36.52 68.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.182 -179.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -56.05 -46.04 79.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.731 0.301 . . . . 0.0 110.887 -178.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -148.84 144.86 27.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.825 0.345 . . . . 0.0 110.666 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -84.12 134.85 34.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.591 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 75.5 m80 -134.14 124.25 25.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.478 179.579 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -60.35 -43.65 96.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.596 179.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -57.17 -41.15 78.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.699 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.559 -179.942 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -105.73 132.7 52.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.022 -179.98 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.23 151.03 27.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.565 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.7 m -127.49 142.47 43.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.388 179.736 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.0 t -94.05 113.08 24.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.584 -179.721 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -66.73 -36.32 82.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.217 179.367 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.95 -39.26 81.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.662 0.267 . . . . 0.0 110.876 -178.452 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp -56.46 -45.78 80.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 0.0 110.674 -179.658 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.43 -47.06 79.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.841 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.07 79.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.187 -176.63 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.54 -52.74 58.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.932 0.396 . . . . 0.0 111.341 -178.469 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.29 -44.94 80.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.078 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -59.81 -40.25 87.75 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.709 -178.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -58.27 -44.96 88.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.402 . . . . 0.0 110.346 -178.738 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -60.5 -46.19 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.571 -179.313 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.32 86.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.523 -179.218 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -59.27 -41.19 88.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.35 -46.93 87.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.054 0.454 . . . . 0.0 109.936 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -124.61 106.78 10.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.179 177.289 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -94.22 -11.86 29.43 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 178.947 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.06 14.97 14.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.557 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.02 94.84 15.75 Favored Pre-proline 0 CA--C 1.533 0.326 0 O-C-N 122.07 -0.394 . . . . 0.0 110.339 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.82 -32.8 23.39 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 121.362 1.374 . . . . 0.0 113.011 -175.279 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.23 -55.46 34.62 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.565 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.32 82.83 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.604 -179.257 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -59.86 -46.1 90.37 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.396 -0.522 . . . . 0.0 109.693 -179.032 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.9 -46.15 74.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 110.484 -176.174 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.87 92.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.264 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -59.11 -44.96 92.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.877 -179.192 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -57.72 -46.25 84.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.298 0.57 . . . . 0.0 110.09 -178.677 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -58.19 -47.04 84.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.57 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.2 mt -58.16 -43.4 87.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.527 -177.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.3 mt -61.07 -41.26 96.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.94 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.2 mt -64.59 -46.1 84.14 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.521 179.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -58.25 -40.82 82.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.014 -177.651 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.7 m -85.73 16.11 4.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.416 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 22.6 m120 61.63 51.63 3.92 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.474 0.654 . . . . 0.0 110.718 176.803 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -124.82 50.39 3.99 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.113 178.032 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -56.87 -40.47 83.96 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.184 1.256 . . . . 0.0 111.591 -175.614 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.7 -37.15 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.147 -179.667 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -69.04 -42.27 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.938 0.399 . . . . 0.0 110.154 -178.67 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 54.4 t -55.29 -41.88 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.249 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 57.9 t -65.7 -53.37 39.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.536 -178.481 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 84.7 p -54.37 -38.11 65.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.942 0.401 . . . . 0.0 111.283 -176.017 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.2 ttt85 -72.97 -53.65 10.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.599 -179.051 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.52 -29.35 64.26 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.028 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.89 -14.28 59.9 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.738 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.6 m -84.79 107.22 10.66 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.25 179.686 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.46 -14.53 21.03 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.208 1.272 . . . . 0.0 113.586 -174.384 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.92 -23.51 76.94 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.302 -0.475 . . . . 0.0 112.919 -177.633 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -98.35 139.97 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 117.483 0.642 . . . . 0.0 110.297 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.19 156.06 19.33 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.76 -176.746 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 66.4 p -141.84 137.95 31.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.356 176.56 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 78.0 p -125.95 163.5 39.08 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.447 177.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -46.24 -45.64 18.05 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 121.446 1.431 . . . . 0.0 112.262 178.33 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.22 -44.68 88.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.371 177.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 59.1 m -59.24 -41.55 88.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.408 . . . . 0.0 110.585 -179.454 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.15 -45.18 87.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.434 -177.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.12 -45.65 90.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.153 0.501 . . . . 0.0 110.322 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.0 mt -57.63 -42.89 84.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.425 -179.835 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -59.54 -47.41 85.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.292 -179.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.3 ttp -56.95 -43.04 81.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.638 -177.665 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -60.08 -49.14 78.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -178.459 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.08 -41.29 83.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.0 0.429 . . . . 0.0 110.496 -177.883 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 60.1 mt -57.05 -44.19 82.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.363 -179.077 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.55 -44.4 93.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.358 178.37 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -55.19 -42.0 72.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.122 -177.417 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 37.3 pt -89.33 14.02 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.82 16.53 79.9 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.331 -0.462 . . . . 0.0 113.429 174.434 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -97.04 89.67 4.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 117.765 0.783 . . . . 0.0 110.047 176.896 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 32.9 p80 -76.48 -42.33 44.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.618 -175.29 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.2 t -55.92 -51.15 68.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 0.0 111.204 -175.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -60.96 -39.5 89.77 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.855 -177.477 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.16 -46.88 87.01 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.662 -177.325 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -55.8 -45.72 78.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.848 0.356 . . . . 0.0 110.94 -179.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.52 76.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.243 -179.075 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 47.6 t -59.17 -45.96 92.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.659 0.266 . . . . 0.0 110.597 -178.621 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 56.6 ttt85 -53.32 -50.0 65.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.353 -178.258 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -55.91 -40.01 72.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.931 179.369 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -64.23 -35.47 80.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.34 179.597 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 83.3 mt -89.33 39.91 0.96 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.068 0.461 . . . . 0.0 110.94 -178.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -57.19 -35.57 69.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.322 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -54.47 -38.96 67.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.704 0.288 . . . . 0.0 111.212 -178.359 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -96.45 136.9 36.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.618 -179.553 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -102.92 130.45 49.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.515 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -91.32 -40.52 11.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.701 179.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 79.5 m80 -130.99 143.59 50.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.483 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 . . . . . 0 C--O 1.221 -0.435 0 CA-C-O 117.887 -1.054 . . . . 0.0 110.573 179.787 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.3 mtp . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.833 0.349 . . . . 1.55 110.939 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.9 mt -56.15 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.49 110.804 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.03 79.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.333 -0.394 . . . . 0.2 111.295 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.5 m -53.5 -52.29 60.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 0.21 111.395 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -45.16 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.31 -0.404 . . . . 1.96 110.928 -179.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.11 -40.41 89.59 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.794 -0.362 . . . . 1.15 110.67 -178.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.38 -44.56 88.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 1.81 110.32 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.24 -45.52 92.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.13 -0.486 . . . . 2.02 110.53 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.59 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 0.13 110.589 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -59.04 -41.34 87.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 1.9 110.923 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -58.81 -45.62 89.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.178 0.513 . . . . 2.58 110.062 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -127.24 106.65 9.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 1.13 110.225 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.1 mt -93.72 -11.89 30.45 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.806 0.669 . . . . 0.15 112.806 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -92.29 14.98 14.76 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.894 0.702 . . . . 0.16 112.894 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.4 t -109.11 94.83 15.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 119.197 -0.43 . . . . 0.2 110.298 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -48.78 -31.69 20.17 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.422 1.414 . . . . 0.13 113.213 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.72 -56.18 25.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.889 0.376 . . . . 2.02 110.591 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.86 -40.55 80.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 0.08 110.536 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.457 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 38.8 mm-40 -59.77 -47.47 85.57 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.628 -0.508 . . . . 0.1 109.628 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.16 73.6 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 0.1 110.483 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.51 -45.48 91.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.869 -0.605 . . . . 0.09 110.297 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -59.63 -43.5 93.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.462 -0.335 . . . . 0.1 110.857 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.498 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.2 m-85 -57.41 -46.23 83.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.377 0.608 . . . . 0.1 110.088 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -46.15 88.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.717 -0.674 . . . . 1.62 110.721 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.5 mt -58.11 -43.86 87.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.044 -0.525 . . . . 0.46 110.578 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.02 -41.6 96.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.11 110.973 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.471 HD12 HD22 ' A' ' 155' ' ' LEU . 15.1 mt -64.3 -46.07 85.19 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.495 -0.482 . . . . 0.17 110.619 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -58.98 -40.06 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.495 -0.32 . . . . 1.82 111.021 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.5 m -85.87 16.32 4.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.219 0.822 . . . . 0.13 113.219 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 62.04 50.79 3.9 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.496 0.665 . . . . 2.1 110.752 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -124.92 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 115.954 -0.566 . . . . 0.15 111.397 177.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -57.57 -39.42 88.54 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.142 1.228 . . . . 0.13 111.663 -175.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.99 -37.86 69.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.294 -0.412 . . . . 2.08 110.987 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.0 -42.77 80.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.985 0.421 . . . . 0.27 109.945 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.9 t -55.45 -41.62 63.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.523 . . . . 0.13 110.306 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' VAL . . . . . 0.504 HG11 ' NH1' ' A' ' 165' ' ' ARG . 61.5 t -66.83 -54.67 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 0.21 110.679 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 89.9 p -54.84 -38.92 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.034 0.445 . . . . 1.23 111.259 -175.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 64.5 ttt-85 -73.04 -50.27 23.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 0.71 111.75 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -56.95 -33.23 66.83 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.947 -0.301 . . . . 0.2 111.609 -176.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -76.86 -8.43 57.32 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.459 0.911 . . . . 1.62 113.459 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.2 m -84.41 107.26 10.41 Favored Pre-proline 0 CA--C 1.536 0.413 0 CA-C-O 118.714 -0.66 . . . . 0.2 110.175 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.7 -15.23 20.05 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 121.242 1.295 . . . . 0.22 113.575 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.68 77.23 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 121.221 -0.514 . . . . 0.18 112.953 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -99.4 142.0 15.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-N 117.569 0.684 . . . . 0.14 110.471 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.457 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.74 156.13 28.07 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.65 -0.705 . . . . 0.13 111.725 -177.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 63.3 p -140.88 137.82 33.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.333 -0.849 . . . . 0.19 110.506 176.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.8 p -125.77 163.18 40.74 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.666 -0.697 . . . . 0.38 109.517 177.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -46.04 -45.83 17.1 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.542 1.495 . . . . 0.21 112.331 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.29 -43.4 88.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 2.04 110.344 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.61 -41.62 90.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.939 0.4 . . . . 0.14 110.551 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.18 -45.79 86.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.989 0.423 . . . . 0.2 110.387 -178.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.73 -45.17 90.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.517 . . . . 1.11 110.288 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.498 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.2 mt -58.41 -43.06 88.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.246 0.546 . . . . 0.16 110.45 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.52 -45.25 89.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.039 -0.528 . . . . 0.26 110.402 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.29 -45.03 84.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.03 -0.532 . . . . 0.52 110.468 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.33 -46.34 86.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.092 -0.504 . . . . 1.85 110.448 -178.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.29 90.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.12 110.348 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.38 -42.79 78.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 0.16 110.613 -178.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.76 -47.39 84.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 1.02 110.227 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -56.32 -41.68 76.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.874 -0.603 . . . . 1.89 111.338 -176.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.6 pt -89.54 13.95 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 113.574 0.953 . . . . 0.16 113.574 -175.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 69.32 25.3 75.59 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 121.366 -0.445 . . . . 0.19 113.027 173.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 165' ' ' ARG . . . . . 0.504 ' NH1' HG11 ' A' ' 138' ' ' VAL . 95.7 mtt180 . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 117.359 0.579 . . . . 2.05 110.211 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.2 mtp . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.936 0.398 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.9 mt -56.32 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.787 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.12 78.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.282 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.5 -52.97 57.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.302 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.87 -44.35 82.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.014 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.41 -40.13 89.89 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.665 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.82 -44.5 86.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.877 0.37 . . . . 0.0 110.382 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -61.52 -48.04 82.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.541 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.69 90.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 -179.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.3 t-20 -61.45 -44.95 96.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.082 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -59.43 -45.28 92.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.988 0.423 . . . . 0.0 110.179 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -125.36 109.47 12.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.318 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 146' ' ' ILE . 28.0 mt -96.76 -11.96 24.33 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -89.09 13.72 12.41 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.5 t -107.99 94.78 13.41 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.19 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -48.84 -36.06 32.69 Favored 'Trans proline' 0 N--CA 1.497 1.695 0 C-N-CA 121.366 1.378 . . . . 0.0 113.057 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.38 -54.43 46.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.3 84.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.557 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.56 -46.42 88.95 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.695 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.71 -46.73 74.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.944 0.402 . . . . 0.0 110.472 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.39 93.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.217 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -59.18 -45.02 92.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.976 0.417 . . . . 0.0 110.839 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.6 m-85 -57.63 -46.4 84.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.254 0.55 . . . . 0.0 110.084 -178.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -58.69 -46.34 87.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.674 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.2 mt -58.33 -43.97 88.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.566 -178.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.27 -41.21 96.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.957 -176.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.457 HD12 HD22 ' A' ' 155' ' ' LEU . 14.3 mt -64.11 -46.06 85.88 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.588 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -58.64 -40.98 84.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.759 0.314 . . . . 0.0 110.973 -177.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.2 m -84.58 15.3 3.85 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.4 t30 62.55 50.37 3.61 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.467 0.651 . . . . 0.0 110.87 177.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -124.85 49.33 3.14 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.353 177.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.479 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.1 Cg_endo -57.19 -39.08 93.15 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.116 1.211 . . . . 0.0 111.751 -174.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.98 -38.06 69.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -68.43 -42.3 79.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.027 0.442 . . . . 0.0 110.08 -179.158 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.42 -42.77 69.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.181 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -65.97 -52.31 50.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.593 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 86.5 p -54.91 -38.02 67.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.836 0.351 . . . . 0.0 111.199 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -72.44 -53.74 11.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.553 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -56.65 -31.6 64.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -76.82 -13.98 59.95 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -82.32 107.9 10.2 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.201 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -57.56 -16.35 23.74 Favored 'Trans proline' 0 N--CA 1.501 1.946 0 C-N-CA 121.238 1.292 . . . . 0.0 113.484 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.52 77.17 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 121.244 -0.503 . . . . 0.0 112.966 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.402 HG12 HD22 ' A' ' 115' ' ' LEU . 75.8 mt -100.02 141.4 17.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 117.57 0.685 . . . . 0.0 110.404 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.39 156.18 26.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.722 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -143.81 137.82 28.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.411 175.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -124.67 165.03 27.24 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.417 177.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -45.91 -44.83 18.17 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 C-N-CA 121.442 1.428 . . . . 0.0 112.508 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.39 -43.81 88.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.269 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.65 -41.22 90.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.646 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.05 -45.4 87.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.356 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.03 -45.97 89.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.127 0.489 . . . . 0.0 110.272 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.479 HD13 ' CB ' ' A' ' 125' ' ' TYR . 41.6 mt -58.24 -41.6 84.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.63 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.545 ' CE2' HD11 ' A' ' 160' ' ' LEU . 47.0 t80 -59.52 -46.51 88.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.454 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.7 ttp -57.57 -45.03 85.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.44 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.08 -46.16 88.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.501 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.51 92.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.545 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.1 mt -56.42 -43.55 79.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.99 0.424 . . . . 0.0 110.625 -178.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.75 -46.23 89.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.222 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 33.0 mtp85 -56.69 -40.65 75.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -176.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.479 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.6 pt -87.97 13.98 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -175.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.63 19.57 79.84 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.358 -0.449 . . . . 0.0 113.289 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' ARG . . . . . 0.417 ' HD2' HD11 ' A' ' 163' ' ' ILE . 84.1 mtt-85 . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 117.678 0.739 . . . . 0.0 110.138 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.3 mmm . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.849 0.357 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.72 -47.12 77.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.037 -178.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.95 -49.09 78.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.457 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.8 m -54.39 -52.29 62.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.95 0.405 . . . . 0.0 111.186 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -44.52 81.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.51 -40.52 91.73 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.679 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -58.34 -44.15 88.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.84 0.352 . . . . 0.0 110.409 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -61.02 -47.07 88.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.542 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.5 -46.23 89.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.676 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -59.49 -42.3 91.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.975 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.5 tttp -59.28 -46.52 88.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.079 0.466 . . . . 0.0 110.053 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -126.49 110.34 13.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.391 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.43 -11.95 26.74 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.13 14.91 14.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 18.9 t -108.13 94.81 13.78 Favored Pre-proline 0 CA--C 1.533 0.29 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.358 178.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -48.87 -34.66 29.08 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.37 1.38 . . . . 0.0 113.071 -174.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.09 -55.2 38.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.894 0.378 . . . . 0.0 110.584 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.09 -41.67 84.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.593 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.422 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.4 mm-40 -59.72 -45.89 90.8 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.351 -0.54 . . . . 0.0 109.675 -178.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.73 75.24 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 110.466 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.15 -44.37 92.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.311 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.36 -44.87 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 110.776 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.4 m-85 -57.61 -46.39 84.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.277 0.56 . . . . 0.0 110.054 -178.556 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -45.51 90.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.732 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.6 mt -58.55 -44.66 89.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.513 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -61.11 -40.97 95.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.926 -176.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.511 HD12 HD22 ' A' ' 155' ' ' LEU . 14.9 mt -64.33 -46.04 85.22 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.583 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.07 -40.59 85.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.7 0.286 . . . . 0.0 110.981 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 63.7 m -85.36 17.14 3.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 61.53 50.9 4.3 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.424 0.631 . . . . 0.0 110.751 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.591 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.266 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.25 -39.5 89.6 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.134 1.222 . . . . 0.0 111.707 -174.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.5 -38.41 69.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.935 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.83 -41.88 77.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.969 0.414 . . . . 0.0 110.169 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.55 -42.45 68.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.205 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.6 t -66.44 -52.88 41.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.676 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.8 m -54.46 -38.3 66.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.925 0.393 . . . . 0.0 111.24 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -72.44 -53.62 11.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.487 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -56.46 -31.69 64.24 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.81 -13.19 60.04 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.0 m -84.29 107.73 11.93 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.266 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -57.59 -14.78 17.96 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 121.224 1.282 . . . . 0.0 113.57 -174.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -22.98 77.19 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.932 -177.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -100.02 140.74 18.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 117.49 0.645 . . . . 0.0 110.301 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.422 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.93 156.1 21.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.754 -176.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -141.79 137.88 31.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.477 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 92.8 p -125.64 163.51 38.45 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.361 177.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -46.0 -44.96 18.37 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.445 1.43 . . . . 0.0 112.488 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -58.76 -44.05 90.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.275 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 60.4 m -59.59 -41.28 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.544 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.81 -45.1 86.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.435 -178.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -59.17 -46.12 89.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.191 0.519 . . . . 0.0 110.272 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.511 HD22 HD12 ' A' ' 129' ' ' LEU . 37.0 mt -58.73 -41.6 86.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.621 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.524 ' CE2' HD11 ' A' ' 160' ' ' LEU . 38.8 t80 -59.14 -46.37 88.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.164 0.507 . . . . 0.0 110.394 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.5 ttp -57.21 -44.56 83.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.527 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.78 -46.65 87.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.511 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.13 -44.0 92.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.279 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.8 mt -56.32 -43.35 78.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 110.672 -178.365 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.37 -46.35 88.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.242 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -57.38 -40.7 78.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.288 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 43.7 pt -89.05 14.06 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.99 24.45 75.81 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.467 -0.397 . . . . 0.0 113.141 173.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 55.6 mtp85 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 117.515 0.658 . . . . 0.0 110.109 176.343 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.2 mtp . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.801 0.334 . . . . 0.0 110.716 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.418 HD23 ' HB3' ' A' ' 127' ' ' LEU . 34.7 mt -55.36 -49.71 71.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 -178.567 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.07 79.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.487 -175.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.4 m -54.24 -52.83 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 111.26 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 87.4 mmt-85 -57.2 -44.24 83.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.89 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -60.26 -40.47 90.45 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.614 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -58.58 -45.63 88.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.837 0.351 . . . . 0.0 110.398 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.92 -46.82 89.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.616 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.77 90.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -59.0 -43.11 91.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.921 -177.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.71 -47.2 87.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.026 0.441 . . . . 0.0 110.177 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -121.54 108.76 13.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.392 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.0 mt -95.93 -11.88 25.95 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.19 14.92 14.76 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.6 t -108.63 94.87 14.96 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.332 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -48.86 -35.3 30.78 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.373 1.382 . . . . 0.0 113.05 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.56 -55.14 38.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.877 0.37 . . . . 0.0 110.653 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.67 83.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.563 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -59.67 -45.87 90.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.349 -0.541 . . . . 0.0 109.753 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.98 -46.76 75.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.976 0.417 . . . . 0.0 110.386 -176.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.22 92.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.216 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -59.16 -44.98 92.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.85 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.486 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.3 m-85 -57.65 -46.4 84.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.319 0.58 . . . . 0.0 110.093 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -58.73 -46.34 87.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.638 -178.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.418 ' HB3' HD23 ' A' ' 104' ' ' LEU . 42.5 mt -58.19 -44.08 87.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 -178.193 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.4 mt -60.98 -40.99 95.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.467 HD12 HD22 ' A' ' 155' ' ' LEU . 14.8 mt -64.36 -46.09 84.95 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.596 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.87 -40.3 83.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.736 0.303 . . . . 0.0 110.996 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -85.7 16.24 4.12 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 29.5 m120 61.93 51.03 3.89 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.462 0.648 . . . . 0.0 110.715 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.83 49.99 3.67 Favored Pre-proline 0 CA--C 1.541 0.613 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.297 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.414 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.5 Cg_endo -56.85 -38.92 94.76 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.18 1.253 . . . . 0.0 111.5 -175.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.12 -38.02 70.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.007 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -68.06 -42.24 80.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.986 0.422 . . . . 0.0 110.122 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.53 -42.38 68.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.17 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.69 -53.34 39.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 -177.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.9 m -54.65 -38.13 66.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.88 0.372 . . . . 0.0 111.212 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.86 -53.38 11.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.521 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -57.69 -30.53 65.56 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.876 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -76.89 -14.27 59.9 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -177.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.5 m -82.66 107.6 9.65 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.199 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.1 -16.98 29.53 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.19 1.26 . . . . 0.0 113.438 -174.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.38 77.01 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.314 -0.47 . . . . 0.0 113.011 -177.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.85 140.37 18.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.52 0.66 . . . . 0.0 110.401 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.7 156.08 24.62 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.621 0.724 . . . . 0.0 111.76 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.3 p -145.29 137.94 26.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.416 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.29 165.02 28.51 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.548 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -45.84 -44.41 18.34 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.467 1.445 . . . . 0.0 112.549 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -59.17 -43.53 92.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.187 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 81.7 m -59.6 -41.43 90.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.606 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.12 -45.71 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.409 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.68 -45.4 89.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.313 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.486 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.3 mt -58.28 -42.51 86.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.509 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -58.8 -45.78 89.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.5 ttp -57.16 -44.33 83.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.503 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -59.09 -46.97 86.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.445 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.47 -43.04 88.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.444 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.9 mt -56.8 -43.87 81.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.498 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -45.73 90.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.15 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -56.04 -42.97 77.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.214 -176.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.454 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.2 pt -90.47 14.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -174.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.59 27.1 70.05 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.021 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' ARG . . . . . 0.454 ' NE ' HD12 ' A' ' 163' ' ' ILE . 85.8 mtt180 . . . . . 0 C--N 1.33 -0.239 0 CA-C-N 117.315 0.558 . . . . 0.0 110.156 175.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.817 0.342 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.512 HD11 ' OG ' ' A' ' 131' ' ' SER . 14.5 mt -53.35 -52.02 60.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.205 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.06 75.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.795 -174.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -53.57 -54.07 42.7 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.598 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.594 ' HD2' HD11 ' A' ' 127' ' ' LEU . 85.5 mtt180 -63.2 -38.26 90.48 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.844 -177.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -60.85 -39.47 89.25 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.529 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -59.24 -47.74 84.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.852 0.358 . . . . 0.0 110.194 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.81 -44.84 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.577 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.04 -47.55 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.621 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -59.5 -41.39 89.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.079 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.19 -47.63 85.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.085 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -121.62 109.72 15.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.32 178.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -94.65 -11.85 28.5 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.2 p -92.1 15.03 14.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -108.74 94.91 15.25 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 119.262 -0.399 . . . . 0.0 110.282 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -48.88 -36.77 34.9 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.319 1.346 . . . . 0.0 113.03 -175.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -57.19 -54.09 50.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.689 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.34 85.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.59 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.5 mm-40 -59.49 -45.54 91.39 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.758 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.41 -46.69 73.22 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 110.471 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.6 92.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.93 -44.25 94.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.936 0.398 . . . . 0.0 110.858 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.495 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.2 m-85 -57.4 -45.97 83.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.324 0.583 . . . . 0.0 110.034 -179.061 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 32.9 mttm -59.16 -44.68 92.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.659 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.594 HD11 ' HD2' ' A' ' 107' ' ' ARG . 13.3 mt -58.06 -46.39 85.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.312 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.7 mt -60.04 -40.64 90.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.973 -175.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.479 HD12 HD22 ' A' ' 155' ' ' LEU . 16.6 mt -65.14 -46.16 82.09 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.692 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.03 -39.44 81.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.755 0.312 . . . . 0.0 111.092 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.512 ' OG ' HD11 ' A' ' 104' ' ' LEU . 63.9 m -86.92 16.97 4.39 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -176.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 62.27 50.27 3.92 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.458 0.646 . . . . 0.0 110.824 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -124.88 49.46 3.25 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.171 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.481 ' HB2' HG23 ' A' ' 163' ' ' ILE . 20.0 Cg_endo -57.58 -39.37 88.89 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.123 1.215 . . . . 0.0 111.544 -175.083 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -56.03 -37.64 69.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.047 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.98 79.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 0.0 110.12 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.35 -41.88 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.23 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.12 -53.2 43.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.498 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.67 -38.35 66.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 111.234 -176.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -72.99 -53.2 11.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.605 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -57.47 -30.77 65.34 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.791 -175.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -76.93 -12.79 60.0 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -84.36 107.41 10.89 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.661 -0.685 . . . . 0.0 110.294 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.13 -15.71 24.32 Favored 'Trans proline' 0 N--CA 1.502 1.978 0 C-N-CA 121.229 1.286 . . . . 0.0 113.549 -174.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -22.82 77.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 121.262 -0.494 . . . . 0.0 112.873 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -99.3 140.33 18.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 117.608 0.704 . . . . 0.0 110.36 -176.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.07 156.13 22.26 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.584 0.707 . . . . 0.0 111.79 -176.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.6 p -141.63 137.87 32.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.413 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.1 p -124.57 163.45 36.63 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.419 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -46.08 17.37 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 121.453 1.435 . . . . 0.0 112.307 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.18 -42.84 86.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.25 -42.44 95.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.56 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -57.99 -44.32 87.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.029 0.442 . . . . 0.0 110.456 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -59.04 -46.19 88.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.191 0.519 . . . . 0.0 110.179 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.495 HD13 ' CB ' ' A' ' 125' ' ' TYR . 41.8 mt -57.7 -42.17 83.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.404 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.8 t80 -59.25 -46.62 88.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.429 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.4 ttp -57.39 -44.04 84.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.526 -178.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.43 -46.81 87.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.494 -178.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.97 89.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.067 0.461 . . . . 0.0 110.465 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.404 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 92.8 mt -56.4 -43.74 79.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.61 -45.85 90.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.209 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -56.14 -41.52 75.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.256 -177.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.481 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.4 pt -88.51 14.19 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.53 22.2 79.1 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 121.373 -0.442 . . . . 0.0 113.206 174.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 117.58 0.69 . . . . 0.0 110.189 176.591 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.8 mtp . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.8 mt -56.39 -47.85 78.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.818 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.4 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.297 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.48 -53.06 56.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.891 0.377 . . . . 0.0 111.329 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -56.35 -44.47 80.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.076 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.56 -40.43 91.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.644 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -58.16 -44.4 87.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.383 . . . . 0.0 110.435 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.64 -47.53 85.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.439 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.29 -46.04 89.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.658 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -59.05 -42.58 90.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.88 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.25 -46.81 87.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.091 0.472 . . . . 0.0 110.07 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -124.42 108.67 12.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.262 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.415 HD22 HG12 ' A' ' 146' ' ' ILE . 90.6 mt -94.84 -11.85 28.07 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.9 15.01 13.97 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 16.7 t -108.83 94.92 15.47 Favored Pre-proline 0 CA--C 1.533 0.314 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.283 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -48.93 -34.96 30.34 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.344 1.362 . . . . 0.0 112.889 -175.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -57.68 -54.86 42.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.908 0.385 . . . . 0.0 110.672 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.95 84.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.557 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.435 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.0 mm-40 -59.42 -45.3 91.92 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.812 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.93 -47.46 74.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.911 0.386 . . . . 0.0 110.388 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.39 92.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.338 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -58.92 -44.9 91.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.462 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.4 m-85 -57.72 -46.47 84.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.338 0.589 . . . . 0.0 110.188 -178.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.619 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.6 mt -58.39 -44.31 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.496 -178.126 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.7 mt -61.48 -41.21 96.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.03 -176.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 155' ' ' LEU . 20.1 mt -64.17 -46.16 85.22 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -59.08 -40.66 85.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.107 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.2 m -84.82 16.12 3.52 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 61.76 51.14 3.99 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.547 0.689 . . . . 0.0 110.676 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.83 49.36 3.15 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.302 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.516 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.2 Cg_endo -56.63 -39.85 88.47 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.144 1.23 . . . . 0.0 111.588 -175.085 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -55.71 -38.22 69.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.065 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.26 -42.66 79.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.031 0.443 . . . . 0.0 110.094 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.39 -42.84 69.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.158 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.13 -52.09 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.578 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -54.57 -38.23 66.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.923 0.392 . . . . 0.0 111.259 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.2 ttt85 -72.57 -53.84 10.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.576 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -56.72 -31.28 64.36 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.59 59.99 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.6 m -83.7 107.54 10.58 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.214 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -57.78 -16.26 24.63 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 121.266 1.311 . . . . 0.0 113.573 -174.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.62 77.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.972 -177.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.415 HG12 HD22 ' A' ' 115' ' ' LEU . 73.0 mt -99.62 139.76 20.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 117.524 0.662 . . . . 0.0 110.34 -176.181 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.435 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.72 156.06 17.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.673 0.749 . . . . 0.0 111.635 -177.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.7 p -149.14 137.88 21.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.399 176.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 p -124.9 165.03 27.74 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.442 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -45.97 -44.77 18.45 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.472 1.448 . . . . 0.0 112.48 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -58.07 -44.47 87.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.987 0.422 . . . . 0.0 110.289 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.5 m -59.11 -41.41 88.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 24.3 mtp -57.71 -43.57 85.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.456 -178.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.71 -46.26 87.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.121 0.486 . . . . 0.0 110.169 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.462 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.5 mt -58.54 -41.9 86.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.532 ' CE2' HD11 ' A' ' 160' ' ' LEU . 47.9 t80 -58.75 -45.67 89.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.174 0.511 . . . . 0.0 110.358 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 59.7 ttp -58.62 -44.25 89.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.586 -179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.59 -45.74 88.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.47 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.4 91.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.345 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.532 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.6 mt -56.33 -42.9 78.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.689 -178.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.14 -46.85 87.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.214 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 22.0 mtp85 -56.12 -41.84 75.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.236 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.516 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.5 pt -88.39 13.95 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.047 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 70.24 24.18 76.81 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.398 -0.429 . . . . 0.0 113.056 174.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 117.47 0.635 . . . . 0.0 110.287 176.38 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 73.3 mtm . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.891 0.377 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.7 mt -56.43 -47.0 79.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.8 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.0 79.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.237 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.37 -53.24 53.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.907 0.384 . . . . 0.0 111.404 -178.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 83.1 mmt-85 -56.57 -44.09 80.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.055 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -60.43 -40.63 91.76 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.581 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.94 -43.96 86.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.97 0.414 . . . . 0.0 110.439 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -60.77 -47.91 84.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.478 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.12 -45.7 90.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.636 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -59.04 -42.88 91.3 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.819 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -59.29 -46.51 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.076 0.465 . . . . 0.0 109.991 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -125.68 109.08 12.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.386 177.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -95.27 -11.9 27.13 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -91.33 14.86 13.34 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.2 t -108.78 94.79 15.08 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-O 119.273 -0.394 . . . . 0.0 110.244 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.8 -34.75 28.89 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.302 1.335 . . . . 0.0 113.037 -175.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -57.71 -55.15 38.61 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.665 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.34 83.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.495 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.407 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.9 mm-40 -59.64 -46.09 90.04 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.668 -179.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.75 -46.82 74.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.95 0.405 . . . . 0.0 110.434 -176.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.52 -44.47 93.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.278 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.85 -44.95 91.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.489 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.8 m-85 -57.85 -46.62 84.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.267 0.556 . . . . 0.0 110.045 -178.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -58.63 -45.44 89.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.43 -44.97 89.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.553 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.15 -40.62 94.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.884 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.473 HD12 HD22 ' A' ' 155' ' ' LEU . 16.3 mt -64.34 -46.09 85.01 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.619 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -58.69 -40.93 85.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.015 -177.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.61 16.1 3.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 62.0 50.58 4.04 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.431 0.634 . . . . 0.0 110.78 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.85 49.4 3.19 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.167 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.507 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.9 Cg_endo -57.61 -38.55 93.17 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.091 1.194 . . . . 0.0 111.688 -174.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.09 -38.19 70.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.0 -42.5 80.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.017 0.437 . . . . 0.0 110.081 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.0 t -55.53 -42.81 69.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.204 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.92 -52.34 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.54 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.6 67.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 111.157 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.2 -53.19 13.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.55 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -56.55 -32.5 65.2 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.656 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -76.85 -11.34 59.81 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -85.01 107.34 11.35 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-O 118.753 -0.641 . . . . 0.0 110.253 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.79 -15.64 22.19 Favored 'Trans proline' 0 N--CA 1.502 1.998 0 C-N-CA 121.26 1.307 . . . . 0.0 113.499 -174.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.85 -22.6 77.01 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.972 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.7 mt -99.99 140.29 19.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.515 0.657 . . . . 0.0 110.339 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.407 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.7 156.1 17.61 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.593 0.711 . . . . 0.0 111.722 -176.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.81 137.88 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.465 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 95.8 p -125.98 163.35 40.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.391 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.02 -45.37 17.78 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.446 1.43 . . . . 0.0 112.422 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -58.26 -43.2 87.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.962 0.41 . . . . 0.0 110.369 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.4 m -59.98 -41.87 92.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.3 mtp -57.91 -44.8 87.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.964 0.411 . . . . 0.0 110.403 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.81 -45.75 89.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.303 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.489 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.5 mt -58.62 -40.91 84.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.615 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.556 ' CE2' HD11 ' A' ' 160' ' ' LEU . 53.2 t80 -59.46 -47.41 85.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.106 0.479 . . . . 0.0 110.495 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.1 ttp -57.65 -44.54 85.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.459 -178.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.26 -45.88 90.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.459 -177.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.95 -43.82 91.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.137 0.494 . . . . 0.0 110.496 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.556 HD11 ' CE2' ' A' ' 156' ' ' TYR . 92.8 mt -56.58 -43.29 79.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.535 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.83 -46.07 90.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.308 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -56.39 -40.81 75.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.225 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.507 HG23 ' HB2' ' A' ' 134' ' ' PRO . 39.6 pt -87.53 13.99 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.184 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.65 17.64 80.04 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 121.326 -0.464 . . . . 0.0 113.429 174.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt-85 . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 117.704 0.752 . . . . 0.0 110.097 176.952 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.9 mtp . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.014 0.435 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.0 mt -56.36 -44.55 80.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.739 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.2 m -53.48 -53.63 48.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.856 0.36 . . . . 0.0 111.306 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -56.47 -44.13 80.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.021 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -60.6 -40.56 92.23 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.657 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -57.94 -44.14 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.408 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.89 -48.0 83.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.568 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.75 90.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.686 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -60.27 -44.05 95.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.919 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -58.9 -45.23 90.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.059 0.457 . . . . 0.0 110.127 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -126.41 107.69 10.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.324 177.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.5 mt -95.03 -11.94 27.5 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.2 p -91.68 15.06 13.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -107.85 94.87 13.3 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 119.284 -0.388 . . . . 0.0 110.151 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -48.85 -34.43 28.26 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.413 1.408 . . . . 0.0 113.056 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -58.24 -55.21 37.98 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.587 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.41 82.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.609 -179.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.408 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.1 mm-40 -59.71 -46.36 89.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.756 -179.132 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.69 -46.79 74.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.921 0.391 . . . . 0.0 110.486 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.32 -45.21 91.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.263 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -59.13 -43.95 91.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.897 -178.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.497 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.8 m-85 -57.58 -46.23 84.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 110.15 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -59.05 -44.85 91.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.678 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.54 -45.28 89.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.528 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.9 mt -60.44 -41.11 93.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.5 HD12 HD22 ' A' ' 155' ' ' LEU . 16.3 mt -64.05 -46.15 85.64 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.666 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -58.85 -40.34 83.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.756 0.313 . . . . 0.0 111.147 -177.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.4 m -84.49 15.61 3.62 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 62.14 50.53 3.93 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.463 0.649 . . . . 0.0 110.727 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.93 49.44 3.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.228 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.486 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.1 Cg_endo -57.15 -39.67 88.88 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.135 1.224 . . . . 0.0 111.673 -175.029 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -55.46 -38.03 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.995 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.46 -42.42 78.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.943 0.402 . . . . 0.0 110.135 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.2 t -55.37 -42.25 66.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.25 -52.45 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.552 -177.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.74 -38.62 67.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 0.0 111.204 -176.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.1 ttt85 -72.21 -53.31 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.531 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -56.58 -31.6 64.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 -176.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -76.89 -12.62 59.98 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.4 m -84.66 107.44 11.33 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.149 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.91 -14.83 19.62 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 C-N-CA 121.232 1.288 . . . . 0.0 113.581 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -23.03 77.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 121.196 -0.526 . . . . 0.0 112.906 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -99.85 140.16 19.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 117.446 0.623 . . . . 0.0 110.235 -176.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.408 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.36 156.1 19.81 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.507 0.67 . . . . 0.0 111.65 -177.147 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.4 p -144.19 137.93 27.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.404 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.11 165.12 29.36 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.477 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -45.94 -44.31 18.85 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.442 1.428 . . . . 0.0 112.474 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -58.43 -44.86 89.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.962 0.41 . . . . 0.0 110.258 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.2 m -59.1 -41.62 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.458 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.77 -45.74 85.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.956 0.408 . . . . 0.0 110.39 -178.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -58.83 -45.67 89.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.216 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.5 HD22 HD12 ' A' ' 129' ' ' LEU . 38.1 mt -58.77 -41.06 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.68 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.562 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.3 t80 -59.53 -47.33 85.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.129 0.49 . . . . 0.0 110.456 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.6 ttp -57.53 -44.14 84.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.451 -178.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -59.3 -46.38 88.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.565 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.121 0.486 . . . . 0.0 110.415 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.562 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.8 mt -56.48 -43.25 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.642 -178.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.91 -46.27 89.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.379 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -56.41 -40.47 74.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.241 -177.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.486 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.0 pt -87.49 13.98 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 113.456 0.909 . . . . 0.0 113.456 -175.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 78.61 15.26 81.1 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 121.322 -0.466 . . . . 0.0 113.506 174.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' ARG . . . . . 0.433 ' HD2' HD11 ' A' ' 163' ' ' ILE . 86.8 mtt-85 . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 117.777 0.789 . . . . 0.0 110.144 177.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.1 mtp . . . . . 0 C--O 1.233 0.191 0 CA-C-O 120.933 0.397 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.6 mt -56.59 -44.4 81.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.759 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.04 79.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.334 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.31 -53.25 53.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.998 0.428 . . . . 0.0 111.346 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -56.86 -45.6 82.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.926 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -59.88 -39.28 84.76 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.761 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -58.06 -45.14 87.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.91 0.386 . . . . 0.0 110.336 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -60.29 -48.07 83.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.362 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.03 -45.87 89.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.603 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -59.32 -42.25 90.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -59.02 -46.33 88.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.022 0.439 . . . . 0.0 110.073 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -127.07 110.91 13.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.495 177.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 96.5 mt -94.13 -11.87 29.6 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 178.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.29 15.08 12.73 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.9 t -108.13 94.79 13.72 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.332 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.93 -39.09 39.85 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.381 1.387 . . . . 0.0 113.14 -175.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -56.81 -51.71 67.91 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.825 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.38 -42.99 92.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.568 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -59.3 -45.19 91.97 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.76 -179.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.22 -47.21 72.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.978 0.418 . . . . 0.0 110.454 -176.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.46 -44.93 92.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.21 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -58.76 -44.51 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 0.0 110.839 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.493 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.1 m-85 -57.65 -46.8 83.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.277 0.561 . . . . 0.0 110.041 -178.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -58.56 -46.04 87.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.697 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.31 -44.22 88.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.571 -178.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.3 mt -60.79 -41.28 95.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.866 -176.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.464 HD12 HD22 ' A' ' 155' ' ' LEU . 16.4 mt -64.47 -46.17 84.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.742 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -59.17 -39.82 83.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.056 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 73.6 m -84.76 15.4 3.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 62.46 50.1 3.81 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.499 0.666 . . . . 0.0 110.869 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -124.88 48.91 2.82 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.421 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.86 -38.27 93.17 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.147 1.231 . . . . 0.0 111.643 -175.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -56.22 -38.21 70.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.01 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.06 -42.12 80.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.044 0.45 . . . . 0.0 110.109 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.62 -43.25 72.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.145 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 45.8 t -65.95 -52.21 51.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.6 -177.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -55.02 -39.06 68.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.831 0.348 . . . . 0.0 111.092 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -72.36 -51.95 18.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.547 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -57.0 -31.62 65.28 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -76.89 -10.06 59.11 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 12.7 m -86.26 106.87 11.22 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.211 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -57.64 -15.0 18.85 Favored 'Trans proline' 0 N--CA 1.5 1.898 0 C-N-CA 121.311 1.341 . . . . 0.0 113.571 -174.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -23.25 77.11 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 121.286 -0.483 . . . . 0.0 112.872 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -98.64 139.77 19.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 117.542 0.671 . . . . 0.0 110.385 -176.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.14 156.1 19.04 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.665 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -144.6 137.84 27.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.515 176.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.86 164.97 29.86 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.414 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -45.81 -43.35 19.29 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 121.454 1.436 . . . . 0.0 112.488 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -59.88 -43.93 94.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.098 178.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.1 m -59.65 -41.46 90.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.572 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.3 mtp -58.13 -45.47 87.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.979 0.419 . . . . 0.0 110.342 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.51 -45.29 89.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.204 0.526 . . . . 0.0 110.231 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.493 HD13 ' CB ' ' A' ' 125' ' ' TYR . 38.7 mt -59.28 -41.22 88.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.611 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.541 ' CE2' HD11 ' A' ' 160' ' ' LEU . 49.1 t80 -58.08 -45.2 87.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.07 0.462 . . . . 0.0 110.218 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 16.5 ttm -57.74 -45.91 85.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -57.81 -45.26 86.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.513 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.75 91.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.969 0.414 . . . . 0.0 110.306 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.541 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.1 mt -56.59 -43.34 80.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.037 0.446 . . . . 0.0 110.532 -178.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.5 -44.39 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.391 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 18.0 mtp180 -56.42 -42.67 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.44 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.8 pt -88.49 14.15 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -174.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.9 23.34 69.57 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.276 -0.487 . . . . 0.0 113.305 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' ARG . . . . . 0.44 ' NE ' HD12 ' A' ' 163' ' ' ILE . 92.5 mtt180 . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 117.448 0.624 . . . . 0.0 110.172 175.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.836 0.35 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.6 mt -56.18 -49.65 73.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.824 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.0 -49.05 79.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.249 -176.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.4 m -53.4 -53.02 57.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.393 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -56.37 -44.3 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.992 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.04 -41.73 92.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.609 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -58.31 -44.03 88.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.79 0.329 . . . . 0.0 110.437 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.16 -47.12 87.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.547 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.52 -46.22 89.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.593 -179.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -59.7 -41.91 91.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -59.5 -46.88 87.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.134 0.492 . . . . 0.0 109.977 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -123.54 106.3 10.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.197 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -93.44 -12.0 30.81 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.26 15.0 14.66 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.6 t -108.03 94.84 13.6 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.351 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -48.75 -34.79 28.69 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.432 1.421 . . . . 0.0 113.155 -174.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.59 -54.91 41.77 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.621 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.1 83.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.53 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.46 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.1 mm-40 -59.77 -46.84 87.93 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.694 -178.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.79 -46.84 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.925 0.393 . . . . 0.0 110.518 -176.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.27 -44.68 92.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.65 -44.22 93.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.922 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.491 ' CB ' HD13 ' A' ' 155' ' ' LEU . 66.7 m-85 -57.65 -46.23 84.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.321 0.582 . . . . 0.0 110.117 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -59.3 -45.14 92.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.679 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.7 mt -59.05 -44.75 91.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.6 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.0 mt -61.11 -41.11 96.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.912 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.535 HD12 HD22 ' A' ' 155' ' ' LEU . 14.4 mt -64.17 -46.05 85.71 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.634 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.15 -40.57 85.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.713 0.292 . . . . 0.0 110.931 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.9 m -84.36 16.31 3.15 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 61.78 50.62 4.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.477 0.656 . . . . 0.0 110.842 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.86 48.58 2.64 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.58 -39.46 88.13 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 121.109 1.206 . . . . 0.0 111.773 -174.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -55.55 -38.21 68.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.04 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.37 -42.86 78.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.019 0.438 . . . . 0.0 109.992 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.3 t -55.3 -42.63 67.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.307 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.7 t -67.05 -53.62 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.716 -176.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 21.6 t -54.83 -39.37 68.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.973 0.416 . . . . 0.0 111.153 -176.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.6 ttt-85 -72.98 -50.47 23.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.692 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.6 -32.84 65.65 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.584 -177.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -76.93 -7.55 55.76 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -177.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 39.2 m -86.67 106.73 11.31 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.105 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_exo -57.42 -13.96 14.8 Favored 'Trans proline' 0 N--CA 1.502 2.002 0 C-N-CA 121.234 1.289 . . . . 0.0 113.667 -174.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -24.13 76.58 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.252 -0.499 . . . . 0.0 112.857 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.2 mt -98.01 142.04 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 117.386 0.593 . . . . 0.0 110.397 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.46 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.27 156.21 26.21 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.554 -177.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.1 p -146.19 137.86 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.543 176.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -123.56 165.09 24.64 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.365 177.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.91 -44.97 18.02 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.439 1.426 . . . . 0.0 112.509 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.44 -43.31 88.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.318 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.0 m -60.11 -42.86 95.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.865 0.364 . . . . 0.0 110.589 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -57.97 -43.4 86.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.441 -178.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -59.04 -46.45 88.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.146 0.498 . . . . 0.0 110.083 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.535 HD22 HD12 ' A' ' 129' ' ' LEU . 35.6 mt -58.52 -41.0 84.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.647 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.505 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 38.7 t80 -58.81 -45.35 90.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.084 0.469 . . . . 0.0 110.387 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 15.1 ttm -57.92 -45.82 85.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.407 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -57.84 -45.49 86.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.521 -176.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.15 -45.73 92.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.979 0.419 . . . . 0.0 110.402 -178.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.505 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 90.4 mt -56.65 -42.68 79.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.005 0.431 . . . . 0.0 110.629 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -60.99 -45.37 95.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.408 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.3 mtp180 -56.63 -41.36 77.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.114 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -87.44 13.99 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.89 21.36 79.84 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.428 -0.415 . . . . 0.0 113.265 173.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 117.626 0.713 . . . . 0.0 110.146 176.569 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.921 0.391 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.2 mt -56.49 -47.65 78.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.745 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -48.98 79.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.121 -177.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.03 -53.2 53.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.892 0.377 . . . . 0.0 111.474 -178.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 82.7 mmt-85 -56.28 -44.51 79.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.954 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -60.34 -39.93 88.87 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.68 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.99 -44.14 87.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.976 0.417 . . . . 0.0 110.389 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -60.88 -47.43 86.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.526 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.36 -45.39 91.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.664 -179.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.32 -42.83 92.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.905 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -59.51 -47.08 86.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.087 0.47 . . . . 0.0 109.982 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.4 108.81 12.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.302 177.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.9 mt -95.92 -11.92 25.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.33 14.76 13.62 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.0 t -108.53 94.78 14.55 Favored Pre-proline 0 CA--C 1.533 0.294 0 O-C-N 122.042 -0.411 . . . . 0.0 110.183 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.86 -34.37 28.12 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.431 1.421 . . . . 0.0 112.894 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.13 -55.33 36.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.816 0.341 . . . . 0.0 110.679 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.02 81.62 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.569 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.436 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.7 mm-40 -59.85 -46.46 89.22 Favored 'General case' 0 N--CA 1.461 0.12 0 C-N-CA 120.382 -0.527 . . . . 0.0 109.672 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.47 74.09 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.936 0.398 . . . . 0.0 110.506 -176.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.99 92.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.247 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -58.72 -45.01 90.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 110.869 -179.122 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.481 ' CB ' HD13 ' A' ' 155' ' ' LEU . 66.1 m-85 -57.64 -46.55 84.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.371 0.605 . . . . 0.0 110.104 -178.555 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.5 mttt -58.82 -45.59 89.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.757 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.8 mt -58.47 -44.47 89.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.522 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.16 -41.13 96.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.959 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.497 HD12 HD22 ' A' ' 155' ' ' LEU . 13.8 mt -64.1 -46.07 85.85 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.492 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.53 -41.44 85.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.738 0.304 . . . . 0.0 111.0 -177.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.52 16.11 3.35 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 61.88 51.18 3.87 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.474 0.654 . . . . 0.0 110.695 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -124.91 49.77 3.53 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.116 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.406 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.8 Cg_endo -56.42 -39.87 88.39 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 121.183 1.256 . . . . 0.0 111.575 -175.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.57 -38.1 68.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.114 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.32 -42.4 79.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.07 0.462 . . . . 0.0 110.117 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.75 -42.47 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.185 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.0 t -66.23 -52.19 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -177.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -54.54 -38.15 66.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.0 111.23 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.7 ttt85 -72.89 -53.94 10.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.499 -178.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -56.64 -31.21 64.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.35 60.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -84.67 107.06 9.98 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.207 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -58.16 -15.22 22.31 Favored 'Trans proline' 0 N--CA 1.501 1.912 0 C-N-CA 121.31 1.34 . . . . 0.0 113.571 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -23.55 76.99 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 121.305 -0.474 . . . . 0.0 112.856 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.9 mt -98.15 139.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 117.529 0.664 . . . . 0.0 110.362 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.436 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.32 156.05 16.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.693 0.759 . . . . 0.0 111.594 -176.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -143.33 137.95 29.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.348 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.5 p -125.35 163.48 38.07 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.304 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -45.96 -45.11 17.97 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 121.378 1.385 . . . . 0.0 112.476 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -58.36 -43.97 88.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.317 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.81 -41.5 91.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -57.91 -44.94 87.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.954 0.407 . . . . 0.0 110.442 -178.342 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.95 -46.22 88.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.248 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.497 HD22 HD12 ' A' ' 129' ' ' LEU . 40.6 mt -58.26 -40.83 82.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.678 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.52 ' CE2' HD11 ' A' ' 160' ' ' LEU . 43.1 t80 -59.37 -47.62 84.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.415 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.2 ttp -57.43 -42.93 83.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' GLU . . . . . 0.435 ' OE1' HD13 ' A' ' 129' ' ' LEU . 92.4 mt-10 -59.22 -47.38 85.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.543 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.77 -43.45 90.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.019 0.437 . . . . 0.0 110.364 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.52 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.7 mt -56.68 -43.77 80.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.588 -178.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.3 -46.04 89.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.151 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.4 mtp85 -56.42 -42.19 77.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.284 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.421 HD12 ' NE ' ' A' ' 165' ' ' ARG . 38.3 pt -89.47 14.16 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -174.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.65 25.59 69.56 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.309 -0.472 . . . . 0.0 113.154 173.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' ARG . . . . . 0.421 ' NE ' HD12 ' A' ' 163' ' ' ILE . 87.9 mtt180 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 117.448 0.624 . . . . 0.0 110.109 175.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 95.0 mmm . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.908 0.385 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.9 mt -56.09 -45.86 79.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.831 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.04 78.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.367 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.19 -52.86 57.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.971 0.415 . . . . 0.0 111.344 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -56.86 -46.14 81.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.014 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.99 -39.01 84.27 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.752 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -57.89 -45.2 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.48 -47.12 87.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.481 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.52 89.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.628 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.46 -42.2 91.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -58.85 -45.5 89.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.126 0.489 . . . . 0.0 110.098 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -126.22 104.85 8.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.117 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 97.1 mt -90.6 -11.86 38.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.75 15.05 15.45 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 2.9 t -107.41 94.88 12.37 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.251 -0.404 . . . . 0.0 110.376 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -48.8 -39.2 38.91 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.447 1.431 . . . . 0.0 113.37 -174.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -57.33 -49.57 75.71 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.78 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.13 98.5 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.39 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.453 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 46.3 mm-40 -59.06 -45.82 89.82 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.61 -47.31 73.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.422 -176.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.49 91.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.311 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -59.66 -44.29 93.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 110.931 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.5 m-85 -57.58 -46.41 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.352 0.596 . . . . 0.0 110.111 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -58.98 -45.22 91.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.709 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.9 mt -58.35 -44.92 88.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.575 -178.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -60.79 -41.65 96.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.926 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.568 HD12 HD22 ' A' ' 155' ' ' LEU . 15.2 mt -63.74 -46.13 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.621 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -58.6 -41.06 84.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.986 -177.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.3 m -84.42 15.67 3.54 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 61.98 50.76 3.97 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.481 0.658 . . . . 0.0 110.769 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.323 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -39.36 91.91 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 121.15 1.233 . . . . 0.0 111.687 -175.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.93 -37.98 69.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.959 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.13 -41.97 80.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.03 0.443 . . . . 0.0 110.129 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.6 t -55.22 -43.23 69.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.153 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.41 -52.17 54.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.61 67.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 0.0 111.172 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.1 ttt85 -72.19 -53.45 12.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.604 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -56.74 -31.56 64.67 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.756 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -76.84 -13.11 60.04 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 32.9 m -83.36 107.63 10.49 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.194 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.69 -15.8 22.33 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 121.215 1.277 . . . . 0.0 113.543 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.76 77.24 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.883 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 75.2 mt -99.88 141.59 16.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 117.615 0.707 . . . . 0.0 110.34 -176.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.453 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.15 156.13 26.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.753 -176.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.5 p -141.71 137.79 31.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.478 176.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 90.1 p -123.9 163.44 35.3 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.365 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -45.99 -46.0 16.66 Favored 'Trans proline' 0 N--CA 1.498 1.775 0 C-N-CA 121.424 1.416 . . . . 0.0 112.442 178.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -58.15 -43.06 87.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.363 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.3 m -60.08 -42.12 93.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.885 0.374 . . . . 0.0 110.601 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -58.02 -44.64 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.332 -178.238 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.85 -45.97 88.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.151 0.5 . . . . 0.0 110.252 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.568 HD22 HD12 ' A' ' 129' ' ' LEU . 36.4 mt -58.84 -41.46 86.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.585 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.537 ' CE2' HD11 ' A' ' 160' ' ' LEU . 45.5 t80 -58.62 -46.29 87.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.128 0.49 . . . . 0.0 110.351 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.0 ttp -57.6 -45.18 85.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.41 -45.64 87.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.45 92.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.461 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.537 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.6 mt -56.69 -43.33 80.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.581 -178.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.75 -46.53 88.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.278 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -56.62 -40.36 75.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.187 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 42.3 pt -88.4 14.0 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.05 14.67 82.38 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 121.415 -0.421 . . . . 0.0 113.592 173.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 61.7 mtt85 . . . . . 0 C--N 1.333 -0.151 0 CA-C-N 117.831 0.816 . . . . 0.0 110.334 177.532 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.5 mtp . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.921 0.391 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.0 mt -56.54 -44.87 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.796 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -49.08 78.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.407 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.3 m -54.01 -53.02 58.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 0.0 111.244 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.2 mmt-85 -56.73 -44.38 81.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.005 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -60.55 -40.35 91.25 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.693 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -58.3 -43.95 88.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 110.373 -178.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -60.76 -47.71 85.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.56 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.35 88.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.642 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.96 -42.0 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.861 -178.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.9 ttmp? -59.65 -46.93 87.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.063 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -124.93 109.98 13.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.451 178.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.8 -11.91 26.14 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 178.485 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.41 14.99 13.14 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.57 94.85 17.43 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.248 178.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -49.0 -34.69 29.98 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.341 1.361 . . . . 0.0 112.867 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -57.55 -55.38 35.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.84 0.352 . . . . 0.0 110.701 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.09 81.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.577 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.415 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.5 mm-40 -59.75 -46.37 89.37 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.684 -179.222 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.65 -46.77 74.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.918 0.389 . . . . 0.0 110.519 -176.155 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.22 -44.61 92.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.261 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -59.25 -44.71 92.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.978 0.418 . . . . 0.0 110.808 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.441 ' CB ' HD13 ' A' ' 155' ' ' LEU . 62.5 m-85 -57.66 -46.68 83.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.286 0.565 . . . . 0.0 110.141 -178.55 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 34.9 mttp -58.45 -46.73 85.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.54 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.18 -44.01 87.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.603 -177.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.2 -41.3 96.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.988 -177.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.468 HD11 ' O ' ' A' ' 155' ' ' LEU . 23.2 mt -64.29 -46.11 85.08 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.645 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -59.39 -40.15 85.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.094 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.8 m -84.17 15.0 3.75 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 -176.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 62.6 50.52 3.49 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.475 0.655 . . . . 0.0 110.76 177.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -124.93 49.6 3.4 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.177 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.521 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.3 Cg_endo -56.46 -40.53 83.98 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.17 1.247 . . . . 0.0 111.541 -175.32 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.13 -38.1 67.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.11 -179.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -68.28 -42.29 79.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.015 0.435 . . . . 0.0 110.021 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.61 -42.98 71.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.177 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 49.9 t -65.4 -51.92 58.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.572 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.5 t -54.73 -38.91 67.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.377 . . . . 0.0 111.258 -176.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -72.13 -53.07 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.539 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.69 -31.59 64.6 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -76.83 -14.52 59.9 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -81.83 107.81 9.42 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.789 -0.624 . . . . 0.0 110.232 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -57.98 -17.14 29.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 121.235 1.29 . . . . 0.0 113.51 -174.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.35 77.07 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.323 -0.465 . . . . 0.0 113.0 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.47 139.83 20.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 117.557 0.679 . . . . 0.0 110.389 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.415 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.31 156.05 16.51 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.633 0.73 . . . . 0.0 111.712 -176.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -144.21 137.83 27.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.457 176.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.3 p -126.0 163.49 39.27 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.42 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -46.04 -45.31 17.95 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.428 1.419 . . . . 0.0 112.477 178.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.23 -43.83 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.34 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.2 m -59.22 -41.61 89.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.498 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.02 -44.94 87.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.003 0.43 . . . . 0.0 110.445 -178.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.6 -45.42 89.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.164 0.507 . . . . 0.0 110.308 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.468 ' O ' HD11 ' A' ' 129' ' ' LEU . 41.7 mt -59.22 -42.21 90.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.477 -179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.548 ' CE2' HD11 ' A' ' 160' ' ' LEU . 50.0 t80 -58.05 -45.12 87.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.201 0.524 . . . . 0.0 110.327 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.99 -46.08 85.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.393 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.24 -45.21 88.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.508 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.54 92.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.075 0.464 . . . . 0.0 110.37 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.548 HD11 ' CE2' ' A' ' 156' ' ' TYR . 94.1 mt -56.17 -42.72 77.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.605 -178.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -59.83 -46.35 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.262 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -55.88 -41.57 74.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.156 -177.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.521 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.4 pt -88.77 14.06 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.35 20.57 79.92 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 121.38 -0.438 . . . . 0.0 113.31 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 117.637 0.719 . . . . 0.0 110.258 176.712 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.6 ttm . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.913 0.387 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.8 mt -55.8 -48.57 75.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.855 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -49.02 79.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -176.526 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.15 -53.24 53.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.009 0.433 . . . . 0.0 111.439 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -56.91 -44.52 82.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.978 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.53 -40.43 87.15 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.507 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -58.32 -45.09 88.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.873 0.368 . . . . 0.0 110.33 -178.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.36 -47.27 86.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.504 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.3 -44.59 92.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.69 -179.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -59.61 -43.2 93.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.863 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -59.3 -46.84 87.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.026 0.441 . . . . 0.0 110.029 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -124.06 108.76 12.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.386 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.43 -11.86 26.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.9 p -92.33 14.99 14.82 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 26.2 t -108.4 94.84 14.39 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 122.033 -0.417 . . . . 0.0 110.326 178.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -48.87 -34.89 29.77 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 121.345 1.363 . . . . 0.0 113.028 -175.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.94 -55.05 39.93 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.653 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.91 84.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.561 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.403 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.7 mm-40 -59.8 -45.52 92.08 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.678 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.57 75.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.969 0.414 . . . . 0.0 110.432 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.38 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.322 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.99 -44.9 91.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.788 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -57.8 -47.46 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -57.97 -46.27 85.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.0 mt -58.58 -44.32 89.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.562 -177.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.4 HD22 ' HB2' ' A' ' 136' ' ' TYR . 19.0 mt -60.34 -40.82 92.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.876 -177.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.86 -46.03 83.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.796 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.85 -39.74 82.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.974 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.3 m -85.33 15.15 4.56 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 62.48 50.43 3.65 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 121.459 0.647 . . . . 0.0 110.848 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.395 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.553 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.8 Cg_endo -56.14 -39.18 92.87 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.305 1.337 . . . . 0.0 111.523 -176.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.63 -38.26 69.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.06 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.4 ' HB2' HD22 ' A' ' 128' ' ' LEU . 17.3 m-85 -67.97 -42.83 80.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.019 0.438 . . . . 0.0 110.024 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.37 -42.09 65.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 55.7 t -65.84 -53.1 41.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.536 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 25.4 m -54.46 -38.04 65.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 111.24 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -72.98 -54.03 9.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.604 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -57.3 -30.3 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.784 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -76.96 -13.99 59.9 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.9 m -84.85 107.12 10.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.78 -0.628 . . . . 0.0 110.325 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -58.39 -15.18 23.28 Favored 'Trans proline' 0 N--CA 1.502 1.973 0 C-N-CA 121.219 1.28 . . . . 0.0 113.612 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.03 77.25 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.896 -177.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.4 mt -98.65 140.18 18.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 117.49 0.645 . . . . 0.0 110.355 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.403 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.64 156.14 20.72 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.544 0.688 . . . . 0.0 111.701 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.0 p -147.15 137.93 23.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.33 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -123.77 165.07 25.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.422 178.062 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.87 -43.96 18.92 Favored 'Trans proline' 0 N--CA 1.498 1.768 0 C-N-CA 121.434 1.423 . . . . 0.0 112.516 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.81 -45.94 88.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.257 177.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 72.1 m -58.0 -40.91 81.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.959 0.409 . . . . 0.0 110.513 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.52 -45.96 87.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.986 0.422 . . . . 0.0 110.456 -177.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -58.57 -44.37 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.255 0.55 . . . . 0.0 110.171 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.86 -42.15 83.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.54 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.421 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 20.9 t80 -58.97 -46.95 86.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.344 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.27 -43.2 82.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.448 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -59.32 -49.64 77.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.317 -178.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.21 -40.93 82.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.443 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.421 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 92.4 mt -56.93 -43.8 81.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.916 0.389 . . . . 0.0 110.444 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.64 -44.6 93.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.198 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 53.7 mtt-85 -55.58 -42.87 75.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.196 -176.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.553 HG23 ' HB2' ' A' ' 134' ' ' PRO . 26.1 pt -90.1 14.08 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.82 26.25 69.74 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 121.272 -0.49 . . . . 0.0 112.985 174.071 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 117.315 0.557 . . . . 0.0 109.952 175.3 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.672 0.273 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 127' ' ' LEU . 26.7 mt -53.88 -52.19 61.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.036 0.446 . . . . 0.0 111.077 -178.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.33 -48.98 75.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.58 -175.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.2 m -53.08 -54.05 41.32 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.703 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.543 ' HD2' HD11 ' A' ' 127' ' ' LEU . 81.5 mtt-85 -63.57 -37.74 88.45 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.846 -177.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -60.51 -39.93 89.59 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.485 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -59.06 -46.5 88.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.871 0.367 . . . . 0.0 110.182 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.08 -45.7 92.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.519 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.76 -46.01 90.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.676 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -58.93 -43.1 91.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.898 -177.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.63 -47.2 87.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.941 0.4 . . . . 0.0 110.115 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -120.02 105.58 11.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.316 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -92.29 -12.01 33.64 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.96 15.04 14.02 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.7 t -107.75 94.66 12.69 Favored Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 118.046 0.385 . . . . 0.0 110.296 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.89 -39.68 39.72 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.44 1.427 . . . . 0.0 113.162 -175.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -56.52 -51.31 69.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.826 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.57 -42.78 93.25 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.511 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -59.1 -45.39 90.99 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.783 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.72 -47.11 74.16 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.934 0.397 . . . . 0.0 110.527 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.1 92.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.278 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -59.83 -44.85 93.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.493 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.3 m-85 -57.4 -46.41 83.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 110.086 -178.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -58.78 -45.86 88.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.748 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.543 HD11 ' HD2' ' A' ' 107' ' ' ARG . 16.6 mt -58.2 -44.82 88.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 -178.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.6 mt -60.61 -40.68 92.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.932 -176.183 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.465 HD12 HD22 ' A' ' 155' ' ' LEU . 16.1 mt -64.66 -46.22 83.43 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.684 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.45 -39.48 83.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.071 -177.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.8 m -86.01 16.62 4.06 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 62.36 50.57 3.71 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.495 0.665 . . . . 0.0 110.857 176.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.9 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.21 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.492 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.7 Cg_endo -57.23 -40.86 79.34 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.233 1.289 . . . . 0.0 111.629 -174.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.55 -37.79 68.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.037 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.22 -42.78 79.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.078 -178.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.43 -42.89 69.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.122 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.8 t -65.52 -52.19 54.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.572 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 m -54.91 -38.85 68.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.238 -176.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.04 -53.28 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.52 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.74 -32.6 65.72 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.011 -0.276 . . . . 0.0 111.661 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.83 -12.36 59.96 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.399 0.889 . . . . 0.0 113.399 -177.017 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.0 m -83.72 107.63 10.9 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.146 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -57.66 -16.67 25.56 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.185 1.256 . . . . 0.0 113.489 -174.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.25 76.97 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.962 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -100.21 140.96 18.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.597 0.698 . . . . 0.0 110.342 -176.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.66 156.11 20.83 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.629 0.728 . . . . 0.0 111.741 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.52 137.91 30.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.426 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 93.7 p -124.55 163.31 37.43 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.384 177.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -45.96 -45.01 18.12 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.483 1.455 . . . . 0.0 112.458 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.33 -43.24 88.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.378 177.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' CYS . . . . . 0.401 ' HA ' HD12 ' A' ' 155' ' ' LEU . 75.8 m -59.75 -41.62 91.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.989 0.423 . . . . 0.0 110.572 -179.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.12 -45.77 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.039 0.447 . . . . 0.0 110.432 -178.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.97 -45.54 90.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.203 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.493 HD13 ' CB ' ' A' ' 125' ' ' TYR . 44.8 mt -58.22 -41.38 83.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.555 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.9 t80 -59.36 -47.37 85.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.203 0.525 . . . . 0.0 110.467 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.72 -44.5 86.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.49 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.41 -45.97 90.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.09 -44.09 91.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.947 0.404 . . . . 0.0 110.32 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.555 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.4 mt -56.4 -43.29 79.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.681 -178.389 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.68 -46.36 89.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 8.7 mtp-105 -56.88 -40.92 77.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.271 -177.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.492 HG23 ' HB2' ' A' ' 134' ' ' PRO . 39.0 pt -87.57 14.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -175.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.61 20.25 79.79 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 119.859 -0.412 . . . . 0.0 113.331 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 117.734 0.767 . . . . 0.0 110.011 176.699 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.3 ttm . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.931 0.396 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.81 -46.39 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.93 79.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.392 -176.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.4 -52.83 58.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.019 0.438 . . . . 0.0 111.397 -178.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -56.71 -45.66 81.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.059 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -60.25 -39.38 86.57 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.705 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' GLN . . . . . 0.4 ' HG2' ' HZ2' ' A' ' 113' ' ' LYS . 38.7 tt0 -57.74 -44.36 85.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.337 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -61.04 -48.66 80.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.496 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.57 -42.81 88.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.686 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -59.11 -43.39 91.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 -178.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.4 ' HZ2' ' HG2' ' A' ' 109' ' ' GLN . 37.4 mttp -58.91 -46.94 86.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.117 0.484 . . . . 0.0 110.076 179.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -125.93 108.8 11.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.473 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.39 -11.96 26.81 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 177.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.61 14.73 14.23 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.1 t -107.87 94.82 13.23 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.066 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -48.78 -34.77 28.81 Favored 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.396 1.397 . . . . 0.0 113.114 -174.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.76 -55.41 35.18 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.652 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.67 85.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.555 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -59.28 -45.56 90.92 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.772 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.74 -49.19 71.42 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.461 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.75 89.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.37 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' PHE . . . . . 0.421 ' HA ' HD12 ' A' ' 127' ' ' LEU . 17.1 t80 -59.28 -44.36 92.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.483 ' CB ' HD13 ' A' ' 155' ' ' LEU . 58.4 m-85 -56.76 -43.98 81.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.349 0.595 . . . . 0.0 110.178 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -58.19 -48.21 81.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.938 -178.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 124' ' ' PHE . 44.3 mt -57.0 -43.88 82.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.612 -176.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.413 HD22 ' HB2' ' A' ' 136' ' ' TYR . 22.3 mt -61.22 -41.02 96.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.956 -177.016 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.454 HD12 HD22 ' A' ' 155' ' ' LEU . 14.0 mt -64.53 -46.05 84.56 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.511 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.72 -40.49 83.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.9 m -85.44 15.98 4.09 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 m120 61.8 51.18 3.94 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.506 0.669 . . . . 0.0 110.718 177.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -124.87 49.88 3.59 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.149 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.44 -39.81 88.8 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.108 1.205 . . . . 0.0 111.58 -175.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.92 -38.15 69.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.994 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' TYR . . . . . 0.413 ' HB2' HD22 ' A' ' 128' ' ' LEU . 4.1 m-85 -68.18 -42.54 79.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.04 0.448 . . . . 0.0 110.086 -178.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.75 -42.86 71.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.151 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.71 -52.12 54.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.647 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -55.06 -38.69 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.82 0.343 . . . . 0.0 111.115 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.03 -53.01 14.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.495 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.61 -32.51 65.34 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.726 -176.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -76.98 -12.18 59.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -177.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.7 m -84.01 107.87 12.06 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.226 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -57.62 -16.3 23.84 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 121.263 1.309 . . . . 0.0 113.542 -174.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -22.66 77.19 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 121.228 -0.51 . . . . 0.0 112.902 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.5 mt -100.89 140.32 20.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.574 0.687 . . . . 0.0 110.281 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.21 156.16 22.68 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.69 0.757 . . . . 0.0 111.578 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.5 p -143.03 137.81 29.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.411 175.458 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -126.1 165.09 29.55 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.463 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.88 -44.12 18.8 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 121.486 1.457 . . . . 0.0 112.424 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.6 -45.35 89.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.903 0.382 . . . . 0.0 110.288 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.4 m -58.78 -41.01 85.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.56 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.18 -45.47 87.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.435 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -59.1 -46.36 88.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.483 HD13 ' CB ' ' A' ' 125' ' ' TYR . 46.5 mt -58.1 -42.25 85.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.519 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.543 ' CE2' HD11 ' A' ' 160' ' ' LEU . 46.8 t80 -59.91 -45.99 90.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.659 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.4 ttp -57.72 -45.44 85.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.411 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -58.73 -46.0 88.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.41 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.19 90.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.09 0.472 . . . . 0.0 110.364 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.543 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.9 mt -56.58 -44.19 80.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.655 -178.459 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -58.95 -46.11 88.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.4 mtp180 -56.62 -41.02 76.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.226 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -89.23 14.05 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -175.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.63 19.78 79.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 121.342 -0.456 . . . . 0.0 113.399 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 117.598 0.699 . . . . 0.0 110.192 176.883 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.6 mtp . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.871 0.367 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.1 mt -56.04 -47.34 78.06 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.956 -178.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.18 78.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.386 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.88 -52.43 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 111.243 -178.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -56.76 -45.7 81.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.62 -40.06 86.31 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.556 -178.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.33 -45.66 87.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.882 0.372 . . . . 0.0 110.401 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -60.25 -46.18 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.453 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.67 84.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.659 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.48 -40.51 87.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.939 -177.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.36 -46.8 87.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.052 0.453 . . . . 0.0 109.976 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -125.48 108.08 11.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.3 177.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.9 mt -93.39 -11.81 31.36 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.43 14.96 15.1 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -108.36 94.82 14.26 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 118.057 0.39 . . . . 0.0 110.291 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -48.83 -34.45 28.18 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 121.417 1.411 . . . . 0.0 113.105 -175.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -58.32 -55.2 38.06 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.629 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.78 -41.67 82.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.641 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.402 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.4 mm-40 -59.8 -46.38 89.4 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.419 -0.512 . . . . 0.0 109.658 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.66 -45.52 73.87 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.98 0.419 . . . . 0.0 110.531 -175.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.49 92.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.204 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -58.99 -44.26 91.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.001 0.429 . . . . 0.0 110.8 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.499 ' CB ' HD13 ' A' ' 155' ' ' LEU . 60.7 m-85 -57.47 -46.79 83.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 0.0 110.063 -178.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -58.19 -46.65 85.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.521 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.28 -43.76 88.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 -177.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.3 mt -61.45 -41.05 96.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.983 -176.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.454 HD11 ' O ' ' A' ' 155' ' ' LEU . 19.6 mt -64.92 -46.03 83.35 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.716 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.4 -39.76 84.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.133 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.5 m -85.27 16.32 3.72 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -176.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 62.16 50.66 3.85 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.488 0.661 . . . . 0.0 110.731 176.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -124.89 49.57 3.35 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.375 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.486 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.2 Cg_endo -57.04 -40.43 83.87 Favored 'Trans proline' 0 N--CA 1.497 1.687 0 C-N-CA 121.168 1.245 . . . . 0.0 111.691 -175.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.66 -37.41 68.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.024 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.81 -42.1 77.74 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.974 0.416 . . . . 0.0 110.135 -178.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.13 -41.82 61.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.269 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 62.0 t -65.26 -53.23 42.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.514 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 m -54.45 -38.42 66.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 111.238 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.2 ttt85 -73.08 -53.27 11.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.535 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -57.37 -30.33 64.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.733 -176.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.79 -12.79 60.03 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.4 m -85.66 106.98 10.81 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.69 -0.671 . . . . 0.0 110.241 179.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.43 -14.17 19.58 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.209 1.273 . . . . 0.0 113.613 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.76 76.83 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.772 -177.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -98.37 140.73 17.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 117.53 0.665 . . . . 0.0 110.377 -176.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.402 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -62.08 156.06 22.47 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.619 0.723 . . . . 0.0 111.719 -177.108 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -144.88 137.86 26.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.505 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.06 165.06 29.66 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.386 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.93 -44.63 18.43 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.476 1.451 . . . . 0.0 112.476 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.34 -44.8 88.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.948 0.404 . . . . 0.0 110.3 177.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' CYS . . . . . 0.421 ' HA ' HD12 ' A' ' 155' ' ' LEU . 74.9 m -58.79 -42.15 88.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.476 -179.357 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.1 mtp -58.82 -45.09 90.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.546 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -58.56 -45.48 88.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.206 0.526 . . . . 0.0 110.19 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.499 HD13 ' CB ' ' A' ' 125' ' ' TYR . 35.1 mt -58.16 -43.19 87.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.284 0.564 . . . . 0.0 110.288 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.405 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.4 t80 -57.9 -45.31 86.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.362 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -57.72 -45.16 86.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.456 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.63 -46.12 87.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.463 -178.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.64 91.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.405 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 93.3 mt -56.36 -43.58 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.581 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -59.71 -46.1 90.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.239 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -56.34 -40.89 75.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.222 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.486 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.8 pt -88.28 13.99 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -174.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.58 19.79 78.93 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.382 -0.437 . . . . 0.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 165' ' ' ARG . . . . . 0.405 ' HD2' HD11 ' A' ' 163' ' ' ILE . 94.3 mtt180 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 117.645 0.723 . . . . 0.0 110.124 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.8 mtp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.948 0.404 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.5 mt -55.57 -47.16 76.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.009 -178.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.69 -49.06 79.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.529 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.6 m -54.08 -52.69 60.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.871 0.367 . . . . 0.0 111.265 -178.288 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 33.6 mmt180 -57.28 -45.16 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.885 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -59.87 -40.2 87.82 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.548 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -58.61 -45.58 88.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.817 0.341 . . . . 0.0 110.308 -178.092 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.35 -46.18 90.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.536 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.62 -48.05 83.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.5 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.27 -40.77 87.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.95 -177.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.4 tttp -59.29 -46.28 88.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.081 0.467 . . . . 0.0 110.008 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -126.11 108.66 11.55 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.317 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -93.47 -11.94 30.87 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.31 15.01 14.73 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 17.7 t -108.51 94.72 14.39 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.255 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -48.73 -34.95 28.97 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 121.379 1.386 . . . . 0.0 113.067 -175.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.77 -55.06 39.74 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.634 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.65 83.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.638 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -59.47 -45.9 90.32 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.74 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.46 -47.2 73.19 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.127 0.489 . . . . 0.0 110.424 -176.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -45.07 92.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.265 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -58.64 -44.27 90.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.808 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.474 ' CB ' HD13 ' A' ' 155' ' ' LEU . 61.7 m-85 -57.58 -46.75 83.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.272 0.558 . . . . 0.0 110.103 -178.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 29.9 mttp -58.51 -45.93 87.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.683 -178.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.47 -44.37 89.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.529 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.87 -41.28 95.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.994 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.492 HD11 ' O ' ' A' ' 155' ' ' LEU . 23.2 mt -64.68 -46.14 83.67 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.714 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.94 -40.02 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.071 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 68.1 m -85.75 16.57 3.91 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 61.76 51.06 4.02 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.42 0.628 . . . . 0.0 110.697 176.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -124.86 49.6 3.36 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.272 177.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.548 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.8 Cg_endo -56.19 -40.65 83.47 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.225 1.283 . . . . 0.0 111.579 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.46 -38.03 68.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.09 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.63 -41.78 78.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 110.188 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.3 t -55.44 -42.39 67.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.235 179.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 52.6 t -65.96 -52.49 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.7 m -54.63 -38.33 66.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.801 0.334 . . . . 0.0 111.212 -176.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -73.06 -53.35 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.516 -178.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -56.78 -31.58 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.91 -12.91 60.02 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.5 m -84.69 107.45 11.38 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-O 118.73 -0.653 . . . . 0.0 110.24 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.83 -15.83 23.19 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 121.238 1.292 . . . . 0.0 113.554 -174.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.08 -22.16 77.18 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.868 -177.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -100.24 139.44 21.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 117.646 0.723 . . . . 0.0 110.266 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.09 156.07 18.94 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.571 0.701 . . . . 0.0 111.861 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.7 p -144.77 137.89 26.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.394 176.017 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -126.03 164.99 30.02 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.547 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.86 -44.84 17.94 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.506 1.471 . . . . 0.0 112.533 179.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.29 -44.03 88.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.981 0.419 . . . . 0.0 110.376 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.7 m -59.17 -41.76 89.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.489 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.33 -45.67 87.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.412 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.53 -45.4 88.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.127 0.489 . . . . 0.0 110.238 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.492 ' O ' HD11 ' A' ' 129' ' ' LEU . 45.0 mt -58.41 -42.67 87.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.347 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -58.12 -45.69 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.124 0.488 . . . . 0.0 110.354 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.06 -44.35 82.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.497 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -58.99 -49.06 79.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.229 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.56 83.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.566 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.81 -43.23 80.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.958 0.408 . . . . 0.0 110.403 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.89 -44.71 94.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.281 177.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -55.48 -43.09 75.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.068 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.548 HG23 ' HB2' ' A' ' 134' ' ' PRO . 31.4 pt -89.24 14.14 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -174.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.93 25.59 68.92 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 121.238 -0.506 . . . . 0.0 113.116 173.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 165' ' ' ARG . . . . . 0.45 ' NE ' HD12 ' A' ' 163' ' ' ILE . 88.3 mtt180 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 117.353 0.577 . . . . 0.0 110.05 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.873 0.368 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.53 -46.48 80.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.3 -49.02 79.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.296 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.67 -53.33 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.357 -178.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -56.72 -43.75 80.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.26 -40.44 90.33 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.61 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -57.99 -43.76 86.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.898 0.38 . . . . 0.0 110.398 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -60.59 -47.81 84.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.482 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.85 90.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.671 -178.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.26 -42.32 90.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.863 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.0 tttp -58.95 -46.02 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.06 0.457 . . . . 0.0 110.036 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -127.68 110.39 12.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.381 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.8 mt -95.3 -11.91 27.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.08 15.01 14.3 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.9 t -108.67 94.87 15.02 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 119.195 -0.431 . . . . 0.0 110.295 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.77 -34.4 27.65 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.402 1.401 . . . . 0.0 113.038 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.79 -55.67 31.89 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.683 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.7 83.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.579 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.408 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 41.9 mm-40 -59.68 -45.8 90.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.739 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.64 75.08 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.963 0.411 . . . . 0.0 110.481 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.39 -44.55 92.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.285 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.04 -44.87 91.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.025 0.44 . . . . 0.0 110.926 -178.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.48 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.6 m-85 -57.7 -46.66 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.341 0.591 . . . . 0.0 110.099 -178.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.7 mttp -58.48 -45.96 87.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.4 mt -58.21 -44.38 88.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 -178.101 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 20.0 mt -60.86 -40.88 94.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.924 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.466 HD12 HD22 ' A' ' 155' ' ' LEU . 15.2 mt -64.42 -46.1 84.69 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.67 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -58.92 -39.93 83.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.746 0.308 . . . . 0.0 111.08 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.7 m -85.05 14.91 4.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -176.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.8 t30 62.53 50.56 3.55 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.499 0.666 . . . . 0.0 110.808 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.204 177.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.514 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.9 Cg_endo -56.96 -39.12 93.77 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 121.159 1.239 . . . . 0.0 111.605 -175.297 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -55.88 -38.07 69.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.05 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -68.41 -42.18 79.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.938 0.399 . . . . 0.0 110.059 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.5 t -55.77 -42.89 71.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.187 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.9 t -65.83 -51.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.617 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.1 t -54.84 -38.7 67.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.931 0.396 . . . . 0.0 111.183 -176.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -72.42 -53.12 13.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.551 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -56.55 -32.15 64.85 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.683 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.88 -11.91 59.89 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -85.28 107.22 11.24 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.292 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.98 -15.22 21.47 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 121.298 1.332 . . . . 0.0 113.502 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.88 77.28 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 121.279 -0.486 . . . . 0.0 112.858 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.3 mt -99.83 141.14 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.514 0.657 . . . . 0.0 110.282 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.408 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.58 156.07 20.65 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.624 0.726 . . . . 0.0 111.689 -176.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -142.8 137.91 30.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.454 176.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 96.7 p -125.97 163.34 40.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.406 177.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.13 -45.22 18.43 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 121.459 1.439 . . . . 0.0 112.454 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.44 -43.48 88.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.251 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.1 m -59.69 -41.36 90.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.562 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.1 -45.16 87.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.999 0.428 . . . . 0.0 110.429 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.81 -45.27 90.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.224 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.48 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.7 mt -58.97 -41.77 88.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.562 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.534 ' CE2' HD11 ' A' ' 160' ' ' LEU . 49.4 t80 -58.8 -45.99 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.184 0.516 . . . . 0.0 110.347 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 64.1 ttp -57.68 -46.01 84.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.39 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.41 -45.23 88.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.503 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.4 -44.49 92.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.436 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.534 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.4 mt -56.09 -42.31 76.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.694 -178.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -60.24 -46.17 90.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.231 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.3 mtp85 -56.43 -41.39 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.216 -177.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.514 HG23 ' HB2' ' A' ' 134' ' ' PRO . 37.2 pt -88.18 14.02 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -175.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.36 24.67 74.95 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 121.498 -0.382 . . . . 0.0 113.06 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 45.1 mtp85 . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 117.485 0.642 . . . . 0.0 110.056 176.238 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.5 mtp . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.773 0.32 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 127' ' ' LEU . 13.7 mt -53.53 -52.11 60.72 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.116 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.46 -49.01 73.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.716 -174.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -54.17 -54.08 44.7 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.583 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.599 ' HD2' HD11 ' A' ' 127' ' ' LEU . 77.8 mtt-85 -63.93 -37.05 85.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.942 -177.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -61.26 -40.14 92.97 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.468 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -59.31 -45.58 90.92 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.19 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -59.95 -45.2 93.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.542 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.32 -47.7 84.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.62 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -58.96 -41.55 87.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.969 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -59.76 -47.16 86.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.073 0.464 . . . . 0.0 110.024 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -125.74 111.12 14.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.366 177.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.7 mt -94.64 -11.99 28.24 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -91.71 15.06 13.52 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.3 t -107.81 94.89 13.23 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.295 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -48.92 -37.22 36.28 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.363 1.375 . . . . 0.0 113.113 -174.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.27 -53.79 54.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 0.0 110.675 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.19 -42.68 86.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.598 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.46 -45.15 92.44 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.77 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -47.08 73.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.937 0.398 . . . . 0.0 110.477 -176.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.02 -44.54 91.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.338 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.71 -43.66 94.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.433 . . . . 0.0 110.863 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.473 ' CB ' HD13 ' A' ' 155' ' ' LEU . 62.6 m-85 -57.64 -46.49 84.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.321 0.581 . . . . 0.0 110.018 -179.125 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.9 mttt -58.89 -42.95 90.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.758 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.599 HD11 ' HD2' ' A' ' 107' ' ' ARG . 14.1 mt -58.26 -48.15 81.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.0 110.35 -179.317 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.39 -40.19 85.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.592 HD12 HD22 ' A' ' 155' ' ' LEU . 23.9 mt -65.37 -46.13 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.832 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -59.02 -39.14 81.0 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.969 -177.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.1 m -87.61 17.34 4.71 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.2 t30 62.15 50.56 3.91 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.431 0.634 . . . . 0.0 110.883 176.194 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.86 49.45 3.23 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.544 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.34 -39.69 89.65 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 121.236 1.291 . . . . 0.0 111.707 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.36 -38.46 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.016 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -67.98 -41.97 81.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.412 . . . . 0.0 110.126 -178.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.95 -43.53 75.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.185 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.2 t -65.1 -51.99 58.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.539 -177.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -55.29 -39.41 69.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.945 0.403 . . . . 0.0 111.135 -176.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -71.66 -51.7 21.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.573 -178.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -57.14 -33.06 67.0 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.649 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -76.96 -10.2 59.21 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.6 m -84.2 107.54 11.17 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.708 -0.663 . . . . 0.0 110.223 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.74 -17.39 29.12 Favored 'Trans proline' 0 N--CA 1.501 1.956 0 C-N-CA 121.237 1.291 . . . . 0.0 113.478 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.91 -21.65 76.8 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.01 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.2 mt -101.08 140.3 20.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 117.58 0.69 . . . . 0.0 110.355 -176.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.61 156.11 24.19 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.767 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -142.8 137.85 29.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.381 176.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.5 p -125.96 165.11 29.17 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.457 177.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.96 -44.58 18.63 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 121.416 1.411 . . . . 0.0 112.482 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.51 -44.36 89.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.273 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.43 -41.91 90.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.401 . . . . 0.0 110.523 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.15 -45.35 87.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.358 -177.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -58.8 -45.9 88.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.206 0.527 . . . . 0.0 110.235 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.592 HD22 HD12 ' A' ' 129' ' ' LEU . 34.5 mt -59.09 -41.33 87.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.556 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.569 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.2 t80 -58.16 -46.56 85.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.178 0.513 . . . . 0.0 110.149 179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.8 ttp -57.72 -43.99 85.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.496 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.78 -46.58 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.553 -178.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.36 91.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.007 0.432 . . . . 0.0 110.352 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.569 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.7 mt -56.78 -43.16 80.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.565 -178.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -46.15 89.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.178 179.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.6 mtp85 -56.19 -42.35 77.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.206 -176.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.428 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.7 pt -89.47 14.07 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.73 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.92 23.13 70.03 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.282 172.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 165' ' ' ARG . . . . . 0.428 ' NE ' HD12 ' A' ' 163' ' ' ILE . 88.3 mtt180 . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 117.516 0.658 . . . . 0.0 110.251 175.976 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.2 mmm . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.851 0.357 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.4 mt -56.2 -48.74 75.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.858 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.64 -49.04 79.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.289 -176.646 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.08 -53.49 49.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.39 -178.554 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.7 -44.74 81.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -178.825 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.14 -39.54 86.69 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.662 -179.18 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -58.06 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.94 0.4 . . . . 0.0 110.318 -178.774 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.4 -47.42 86.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.435 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.09 91.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.668 -178.983 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -59.35 -43.18 92.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.842 -178.371 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -59.11 -46.32 88.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.09 0.472 . . . . 0.0 110.095 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -125.72 108.88 11.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.33 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.16 -11.88 27.37 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 178.54 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.82 14.95 14.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.2 t -108.25 94.73 13.87 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.206 -0.426 . . . . 0.0 110.285 178.485 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -48.76 -34.53 27.98 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.411 1.407 . . . . 0.0 113.053 -175.276 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -58.03 -55.43 35.06 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.593 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.83 83.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.574 -179.042 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.41 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.1 mm-40 -59.81 -45.89 90.92 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.665 -178.924 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.53 74.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.003 0.43 . . . . 0.0 110.544 -176.297 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.82 92.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.307 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -59.17 -44.35 92.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.928 0.394 . . . . 0.0 110.834 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.489 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.7 m-85 -57.73 -46.61 84.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.132 -178.765 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -58.55 -45.93 87.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.676 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.3 -44.51 88.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.542 -178.039 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.6 mt -60.96 -41.06 95.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.859 -176.807 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.464 HD12 HD22 ' A' ' 155' ' ' LEU . 12.6 mt -63.93 -46.11 86.22 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.611 179.818 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.79 -40.56 84.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.029 -177.677 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -84.85 15.99 3.62 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 61.75 50.86 4.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.792 177.01 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.9 49.15 3.0 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.275 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.52 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.0 Cg_endo -57.51 -39.75 86.19 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 121.111 1.207 . . . . 0.0 111.765 -174.755 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.6 -37.94 68.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.0 -179.65 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.9 79.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.001 0.429 . . . . 0.0 110.176 -179.075 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.36 -42.72 68.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.247 179.249 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 44.8 t -65.57 -52.23 53.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.5 -177.618 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.1 m -54.87 -39.06 68.27 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.883 0.373 . . . . 0.0 111.191 -176.526 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -71.86 -52.72 16.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.592 -178.928 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.29 -32.91 65.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -176.228 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -76.81 -12.21 59.94 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.009 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 27.0 m -83.44 107.82 11.21 Favored Pre-proline 0 CA--C 1.535 0.385 0 CA-C-O 118.669 -0.681 . . . . 0.0 110.338 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.61 -16.62 25.05 Favored 'Trans proline' 0 N--CA 1.501 1.947 0 C-N-CA 121.249 1.299 . . . . 0.0 113.516 -174.689 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.03 -22.9 77.34 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.842 -177.1 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.9 140.77 18.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.567 0.683 . . . . 0.0 110.28 -176.305 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.41 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.51 156.05 20.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.569 0.699 . . . . 0.0 111.749 -176.99 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.0 p -142.23 137.89 31.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.405 176.53 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.9 p -126.02 163.23 40.95 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.522 177.801 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.08 -45.26 18.18 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.43 1.42 . . . . 0.0 112.472 178.728 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.33 -43.31 88.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.308 177.964 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.6 m -59.81 -41.51 91.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.554 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.07 -45.21 87.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.372 -178.28 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.73 -45.45 89.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.13 0.491 . . . . 0.0 110.207 179.725 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.489 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.3 mt -59.03 -40.94 86.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.712 -179.729 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.537 ' CE2' HD11 ' A' ' 160' ' ' LEU . 57.4 t80 -58.78 -47.24 85.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.127 0.489 . . . . 0.0 110.256 179.779 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.2 ttp -57.95 -44.8 87.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.42 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.45 -45.15 89.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.538 -178.077 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.54 93.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.049 0.452 . . . . 0.0 110.496 -178.241 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.537 HD11 ' CE2' ' A' ' 156' ' ' TYR . 92.2 mt -56.56 -41.96 77.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.589 -178.958 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -60.7 -45.78 92.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.445 178.687 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 -56.19 -41.03 74.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.178 -177.111 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.52 HG23 ' HB2' ' A' ' 134' ' ' PRO . 36.0 pt -86.48 14.03 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -175.517 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.54 20.0 79.77 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 121.502 -0.38 . . . . 0.0 113.182 174.504 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 117.696 0.748 . . . . 0.0 109.848 177.39 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 72.8 mtm . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.789 0.328 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.4 -48.01 75.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.96 -178.634 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.04 79.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.372 -176.343 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.33 -51.79 61.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.907 0.384 . . . . 0.0 111.344 -178.217 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -56.8 -46.11 81.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.002 -179.037 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -59.83 -40.01 87.04 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.582 -179.033 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.34 -45.78 87.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.323 -178.482 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -60.29 -46.66 89.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.563 -178.681 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.05 89.52 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 -179.511 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 56.2 t-20 -59.05 -43.41 91.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.026 -177.802 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -60.07 -47.31 86.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.951 0.405 . . . . 0.0 110.133 -179.481 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -121.92 108.85 13.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.383 178.151 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.4 mt -95.65 -11.88 26.47 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 178.429 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 80.0 p -92.36 15.07 14.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.152 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.9 t -109.09 94.79 15.84 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.208 178.249 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -48.87 -35.19 30.59 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.411 1.407 . . . . 0.0 112.92 -175.437 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -57.77 -54.93 41.33 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.667 -179.659 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.7 81.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.576 -179.02 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.413 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 44.8 mm-40 -59.82 -47.05 87.29 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.689 -179.191 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.43 -46.34 73.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.883 0.373 . . . . 0.0 110.583 -175.976 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.53 91.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.245 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -58.63 -44.57 90.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.854 -179.15 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.445 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.2 m-85 -57.71 -46.76 83.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.327 0.584 . . . . 0.0 110.114 -178.504 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -58.46 -46.41 86.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.678 -178.136 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 44.6 mt -58.67 -44.34 90.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.544 -178.088 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.4 mt -61.4 -40.68 95.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.946 -176.643 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.467 HD11 ' O ' ' A' ' 155' ' ' LEU . 18.6 mt -64.92 -46.14 82.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.655 179.879 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.45 -39.71 84.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.693 0.283 . . . . 0.0 111.101 -177.792 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.3 m -85.64 16.42 3.94 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -176.774 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 58.3 t30 62.18 50.85 3.75 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.464 0.65 . . . . 0.0 110.848 176.705 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.95 48.68 2.73 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.397 177.573 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.499 ' HB2' HG23 ' A' ' 163' ' ' ILE . 19.1 Cg_endo -57.3 -39.38 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.133 1.222 . . . . 0.0 111.694 -174.568 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.95 -38.18 69.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.021 -179.12 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -69.38 -41.61 76.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.905 0.383 . . . . 0.0 110.016 -179.047 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.6 t -55.34 -42.82 68.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.153 179.179 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -66.4 -52.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.646 -177.541 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 85.0 p -54.64 -37.7 65.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.832 0.349 . . . . 0.0 111.205 -176.666 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.92 -54.02 9.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.54 -179.077 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.64 -30.91 63.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.838 0.311 . . . . 0.0 111.838 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.81 -16.03 59.56 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.959 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 9.2 m -81.25 107.91 9.11 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.218 -179.7 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -57.62 -16.39 24.2 Favored 'Trans proline' 0 N--CA 1.502 1.994 0 C-N-CA 121.13 1.22 . . . . 0.0 113.501 -174.384 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -23.4 77.06 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 121.296 -0.478 . . . . 0.0 112.913 -177.074 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.23 140.73 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 117.51 0.655 . . . . 0.0 110.362 -176.076 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.413 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.48 156.05 20.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.637 0.732 . . . . 0.0 111.8 -176.95 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.1 p -144.15 137.89 27.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.418 176.237 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.2 p -125.55 163.53 38.17 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.259 177.671 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -45.97 -45.11 18.03 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 121.527 1.485 . . . . 0.0 112.456 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.34 -44.12 88.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.271 177.903 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.53 -41.23 89.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.545 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.04 -45.22 87.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.952 0.406 . . . . 0.0 110.427 -178.069 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -58.73 -45.79 88.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.138 0.494 . . . . 0.0 110.223 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.467 ' O ' HD11 ' A' ' 129' ' ' LEU . 41.6 mt -58.72 -41.64 86.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.536 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.535 ' CE2' HD11 ' A' ' 160' ' ' LEU . 45.5 t80 -58.63 -46.06 87.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.162 0.506 . . . . 0.0 110.375 179.661 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -58.08 -44.38 87.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.453 -178.995 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.74 -47.01 86.09 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.42 -177.952 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.72 90.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.063 0.458 . . . . 0.0 110.374 -178.409 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.535 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.7 mt -56.33 -43.47 79.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.594 -178.655 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.48 -46.47 88.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.228 179.715 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -56.73 -40.79 76.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.263 -176.896 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.499 HG23 ' HB2' ' A' ' 134' ' ' PRO . 41.0 pt -88.5 14.08 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.118 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.71 19.35 79.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.423 -0.418 . . . . 0.0 113.371 174.422 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 165' ' ' ARG . . . . . 0.402 ' HD2' HD11 ' A' ' 163' ' ' ILE . 93.2 mtt180 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 117.659 0.73 . . . . 0.0 110.17 176.78 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.919 0.39 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.43 -47.06 79.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.841 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.07 79.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.187 -176.63 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.54 -52.74 58.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.932 0.396 . . . . 0.0 111.341 -178.469 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.29 -44.94 80.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.078 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -59.81 -40.25 87.75 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.709 -178.805 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -58.27 -44.96 88.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.402 . . . . 0.0 110.346 -178.738 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -60.5 -46.19 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.571 -179.313 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.32 86.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.523 -179.218 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -59.27 -41.19 88.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.35 -46.93 87.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.054 0.454 . . . . 0.0 109.936 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -124.61 106.78 10.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.179 177.289 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -94.22 -11.86 29.43 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 178.947 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.06 14.97 14.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.557 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.02 94.84 15.75 Favored Pre-proline 0 CA--C 1.533 0.326 0 O-C-N 122.07 -0.394 . . . . 0.0 110.339 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.82 -32.8 23.39 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 121.362 1.374 . . . . 0.0 113.011 -175.279 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.23 -55.46 34.62 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.565 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.32 82.83 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.604 -179.257 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.416 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 41.3 mm-40 -59.86 -46.1 90.37 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.396 -0.522 . . . . 0.0 109.693 -179.032 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.9 -46.15 74.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 110.484 -176.174 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.87 92.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.264 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -59.11 -44.96 92.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.877 -179.192 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 125' ' ' TYR . . . . . 0.507 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.5 m-85 -57.72 -46.25 84.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.298 0.57 . . . . 0.0 110.09 -178.677 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -58.19 -47.04 84.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.57 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.2 mt -58.16 -43.4 87.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.527 -177.693 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.3 mt -61.07 -41.26 96.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.94 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.461 HD12 HD22 ' A' ' 155' ' ' LEU . 14.2 mt -64.59 -46.1 84.14 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.521 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -58.25 -40.82 82.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.014 -177.651 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.7 m -85.73 16.11 4.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.416 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 22.6 m120 61.63 51.63 3.92 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.474 0.654 . . . . 0.0 110.718 176.803 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -124.82 50.39 3.99 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.113 178.032 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 134' ' ' PRO . . . . . 0.516 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.7 Cg_endo -56.87 -40.47 83.96 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.184 1.256 . . . . 0.0 111.591 -175.614 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.7 -37.15 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.147 -179.667 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -69.04 -42.27 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.938 0.399 . . . . 0.0 110.154 -178.67 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 54.4 t -55.29 -41.88 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.249 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 57.9 t -65.7 -53.37 39.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.536 -178.481 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 84.7 p -54.37 -38.11 65.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.942 0.401 . . . . 0.0 111.283 -176.017 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.2 ttt85 -72.97 -53.65 10.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.599 -179.051 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.52 -29.35 64.26 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.028 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.89 -14.28 59.9 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.738 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.6 m -84.79 107.22 10.66 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.25 179.686 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.46 -14.53 21.03 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.208 1.272 . . . . 0.0 113.586 -174.384 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.92 -23.51 76.94 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.302 -0.475 . . . . 0.0 112.919 -177.633 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -98.35 139.97 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 117.483 0.642 . . . . 0.0 110.297 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.416 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.19 156.06 19.33 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.76 -176.746 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 66.4 p -141.84 137.95 31.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.356 176.56 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 78.0 p -125.95 163.5 39.08 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.447 177.985 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -46.24 -45.64 18.05 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 121.446 1.431 . . . . 0.0 112.262 178.33 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.22 -44.68 88.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.371 177.966 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 152' ' ' CYS . . . . . 0.405 ' HA ' HD12 ' A' ' 155' ' ' LEU . 59.1 m -59.24 -41.55 88.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.408 . . . . 0.0 110.585 -179.454 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.15 -45.18 87.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.434 -177.849 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.12 -45.65 90.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.153 0.501 . . . . 0.0 110.322 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 155' ' ' LEU . . . . . 0.507 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.0 mt -57.63 -42.89 84.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.425 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 156' ' ' TYR . . . . . 0.529 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.2 t80 -59.54 -47.41 85.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.292 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 157' ' ' MET . . . . . 0.48 ' HA ' HD12 ' A' ' 160' ' ' LEU . 61.3 ttp -56.95 -43.04 81.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.638 -177.665 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -60.08 -49.14 78.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -178.459 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.08 -41.29 83.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.0 0.429 . . . . 0.0 110.496 -177.883 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 160' ' ' LEU . . . . . 0.529 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 60.1 mt -57.05 -44.19 82.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.363 -179.077 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.55 -44.4 93.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.358 178.37 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -55.19 -42.0 72.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.122 -177.417 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 163' ' ' ILE . . . . . 0.516 HG23 ' HB2' ' A' ' 134' ' ' PRO . 37.3 pt -89.33 14.02 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.875 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.82 16.53 79.9 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.331 -0.462 . . . . 0.0 113.429 174.434 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 117.765 0.783 . . . . 0.0 110.047 176.896 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 44.0 ttm . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.344 -0.613 . . . . 8.16 109.344 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.2 t -109.76 132.37 58.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.201 -0.454 . . . . 4.82 110.021 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.95 156.67 33.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 3.29 110.552 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.2 t -97.82 137.92 24.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 2.4 109.998 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 55.5 m -93.91 144.3 25.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 1.18 110.825 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -79.03 -22.03 46.04 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.983 -0.553 . . . . 3.36 112.463 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.88 -34.17 71.34 Favored 'General case' 0 C--N 1.334 -0.107 0 O-C-N 122.336 -0.228 . . . . 0.48 111.485 -177.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.3 mtp -55.26 -47.19 75.81 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.833 0.349 . . . . 1.55 110.939 -179.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.9 mt -56.15 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.49 110.804 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.03 79.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.333 -0.394 . . . . 0.2 111.295 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.5 m -53.5 -52.29 60.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 0.21 111.395 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -45.16 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.31 -0.404 . . . . 1.96 110.928 -179.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.11 -40.41 89.59 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.794 -0.362 . . . . 1.15 110.67 -178.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.38 -44.56 88.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 1.81 110.32 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.24 -45.52 92.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.13 -0.486 . . . . 2.02 110.53 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.59 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 0.13 110.589 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -59.04 -41.34 87.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 1.9 110.923 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -58.81 -45.62 89.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.178 0.513 . . . . 2.58 110.062 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -127.24 106.65 9.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 1.13 110.225 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.1 mt -93.72 -11.89 30.45 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.806 0.669 . . . . 0.15 112.806 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -92.29 14.98 14.76 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.894 0.702 . . . . 0.16 112.894 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.4 t -109.11 94.83 15.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 119.197 -0.43 . . . . 0.2 110.298 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -48.78 -31.69 20.17 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.422 1.414 . . . . 0.13 113.213 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.72 -56.18 25.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.889 0.376 . . . . 2.02 110.591 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.86 -40.55 80.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 0.08 110.536 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.457 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 38.8 mm-40 -59.77 -47.47 85.57 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.628 -0.508 . . . . 0.1 109.628 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.16 73.6 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 0.1 110.483 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.51 -45.48 91.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.869 -0.605 . . . . 0.09 110.297 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -59.63 -43.5 93.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.462 -0.335 . . . . 0.1 110.857 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.498 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.2 m-85 -57.41 -46.23 83.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.377 0.608 . . . . 0.1 110.088 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -46.15 88.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.717 -0.674 . . . . 1.62 110.721 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.5 mt -58.11 -43.86 87.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.044 -0.525 . . . . 0.46 110.578 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.02 -41.6 96.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.11 110.973 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.471 HD12 HD22 ' A' ' 155' ' ' LEU . 15.1 mt -64.3 -46.07 85.19 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.495 -0.482 . . . . 0.17 110.619 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -58.98 -40.06 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.495 -0.32 . . . . 1.82 111.021 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.5 m -85.87 16.32 4.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.219 0.822 . . . . 0.13 113.219 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 62.04 50.79 3.9 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.496 0.665 . . . . 2.1 110.752 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -124.92 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 115.954 -0.566 . . . . 0.15 111.397 177.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -57.57 -39.42 88.54 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.142 1.228 . . . . 0.13 111.663 -175.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.99 -37.86 69.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.294 -0.412 . . . . 2.08 110.987 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.0 -42.77 80.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.985 0.421 . . . . 0.27 109.945 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.9 t -55.45 -41.62 63.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.523 . . . . 0.13 110.306 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' VAL . . . . . 0.504 HG11 ' NH1' ' A' ' 165' ' ' ARG . 61.5 t -66.83 -54.67 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 0.21 110.679 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 89.9 p -54.84 -38.92 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.034 0.445 . . . . 1.23 111.259 -175.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 64.5 ttt-85 -73.04 -50.27 23.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 0.71 111.75 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -56.95 -33.23 66.83 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.947 -0.301 . . . . 0.2 111.609 -176.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -76.86 -8.43 57.32 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.459 0.911 . . . . 1.62 113.459 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.2 m -84.41 107.26 10.41 Favored Pre-proline 0 CA--C 1.536 0.413 0 CA-C-O 118.714 -0.66 . . . . 0.2 110.175 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.7 -15.23 20.05 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 121.242 1.295 . . . . 0.22 113.575 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.68 77.23 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 121.221 -0.514 . . . . 0.18 112.953 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -99.4 142.0 15.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-N 117.569 0.684 . . . . 0.14 110.471 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.457 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.74 156.13 28.07 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.65 -0.705 . . . . 0.13 111.725 -177.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 63.3 p -140.88 137.82 33.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.333 -0.849 . . . . 0.19 110.506 176.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.8 p -125.77 163.18 40.74 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.666 -0.697 . . . . 0.38 109.517 177.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -46.04 -45.83 17.1 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.542 1.495 . . . . 0.21 112.331 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.29 -43.4 88.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 2.04 110.344 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.61 -41.62 90.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.939 0.4 . . . . 0.14 110.551 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.18 -45.79 86.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.989 0.423 . . . . 0.2 110.387 -178.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.73 -45.17 90.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.517 . . . . 1.11 110.288 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.498 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.2 mt -58.41 -43.06 88.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.246 0.546 . . . . 0.16 110.45 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.52 -45.25 89.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.039 -0.528 . . . . 0.26 110.402 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.29 -45.03 84.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.03 -0.532 . . . . 0.52 110.468 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.33 -46.34 86.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.092 -0.504 . . . . 1.85 110.448 -178.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.29 90.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.12 110.348 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.38 -42.79 78.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 0.16 110.613 -178.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.76 -47.39 84.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 1.02 110.227 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -56.32 -41.68 76.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.874 -0.603 . . . . 1.89 111.338 -176.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.6 pt -89.54 13.95 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 113.574 0.953 . . . . 0.16 113.574 -175.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 69.32 25.3 75.59 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 121.366 -0.445 . . . . 0.19 113.027 173.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.504 ' NH1' HG11 ' A' ' 138' ' ' VAL . 95.7 mtt180 -97.12 86.03 3.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 117.359 0.579 . . . . 2.05 110.211 176.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -66.56 -47.48 72.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 3.27 111.419 -177.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -55.95 -51.1 68.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.761 0.315 . . . . 1.35 111.166 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.15 -38.8 84.21 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.861 -0.335 . . . . 1.21 110.993 -177.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.69 -48.4 80.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.932 0.396 . . . . 0.2 110.361 -178.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -55.24 -43.94 75.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.334 -0.393 . . . . 2.0 111.043 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.85 -47.68 82.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.396 -0.365 . . . . 0.39 111.054 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.4 t -57.4 -46.29 85.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 121.015 -0.274 . . . . 0.28 110.534 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -53.0 -48.87 67.19 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.76 0.314 . . . . 3.34 111.417 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -55.93 -39.06 71.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 1.65 110.981 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -62.17 -40.54 96.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.52 -0.309 . . . . 2.23 110.707 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 77.9 mt -65.82 -37.99 87.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 1.46 111.121 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -55.96 -38.26 70.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.522 -0.308 . . . . 4.36 111.078 -178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 51.1 t60 -129.18 100.9 5.79 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.811 0.339 . . . . 6.46 110.451 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -66.54 -55.44 15.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 7.9 110.767 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -150.1 -68.15 0.2 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 9.97 110.628 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -120.96 -41.03 2.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.356 -0.384 . . . . 12.9 110.606 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -106.54 139.27 41.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.286 -0.415 . . . . 16.02 110.605 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 77.2 m80 . . . . . 0 C--O 1.22 -0.47 0 CA-C-O 117.976 -1.012 . . . . 15.33 110.568 179.982 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.3 mtm . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.0 t -59.84 -43.23 91.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.006 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.04 146.49 43.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.63 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.6 m -129.23 142.11 44.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.36 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 60.6 p -94.03 148.03 22.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.767 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -60.74 -29.2 69.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.954 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.92 -36.3 74.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.534 0.207 . . . . 0.0 111.239 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.2 mtp -55.98 -46.38 78.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.936 0.398 . . . . 0.0 110.822 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.9 mt -56.32 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.787 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.12 78.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.282 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.5 -52.97 57.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.302 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.87 -44.35 82.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.014 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.41 -40.13 89.89 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.665 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.82 -44.5 86.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.877 0.37 . . . . 0.0 110.382 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -61.52 -48.04 82.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.541 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.69 90.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 -179.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.3 t-20 -61.45 -44.95 96.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.082 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -59.43 -45.28 92.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.988 0.423 . . . . 0.0 110.179 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -125.36 109.47 12.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.318 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 146' ' ' ILE . 28.0 mt -96.76 -11.96 24.33 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -89.09 13.72 12.41 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.5 t -107.99 94.78 13.41 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.19 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -48.84 -36.06 32.69 Favored 'Trans proline' 0 N--CA 1.497 1.695 0 C-N-CA 121.366 1.378 . . . . 0.0 113.057 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.38 -54.43 46.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.3 84.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.557 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.56 -46.42 88.95 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.695 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.71 -46.73 74.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.944 0.402 . . . . 0.0 110.472 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.39 93.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.217 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -59.18 -45.02 92.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.976 0.417 . . . . 0.0 110.839 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.6 m-85 -57.63 -46.4 84.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.254 0.55 . . . . 0.0 110.084 -178.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -58.69 -46.34 87.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.674 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.2 mt -58.33 -43.97 88.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.566 -178.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.27 -41.21 96.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.957 -176.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.457 HD12 HD22 ' A' ' 155' ' ' LEU . 14.3 mt -64.11 -46.06 85.88 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.588 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -58.64 -40.98 84.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.759 0.314 . . . . 0.0 110.973 -177.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.2 m -84.58 15.3 3.85 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.4 t30 62.55 50.37 3.61 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.467 0.651 . . . . 0.0 110.87 177.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -124.85 49.33 3.14 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.353 177.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.479 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.1 Cg_endo -57.19 -39.08 93.15 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.116 1.211 . . . . 0.0 111.751 -174.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.98 -38.06 69.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -68.43 -42.3 79.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.027 0.442 . . . . 0.0 110.08 -179.158 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.42 -42.77 69.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.181 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -65.97 -52.31 50.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.593 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 86.5 p -54.91 -38.02 67.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.836 0.351 . . . . 0.0 111.199 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -72.44 -53.74 11.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.553 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -56.65 -31.6 64.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -76.82 -13.98 59.95 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -82.32 107.9 10.2 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.201 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -57.56 -16.35 23.74 Favored 'Trans proline' 0 N--CA 1.501 1.946 0 C-N-CA 121.238 1.292 . . . . 0.0 113.484 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.52 77.17 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 121.244 -0.503 . . . . 0.0 112.966 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.402 HG12 HD22 ' A' ' 115' ' ' LEU . 75.8 mt -100.02 141.4 17.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 117.57 0.685 . . . . 0.0 110.404 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.39 156.18 26.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.722 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -143.81 137.82 28.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.411 175.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -124.67 165.03 27.24 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.417 177.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -45.91 -44.83 18.17 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 C-N-CA 121.442 1.428 . . . . 0.0 112.508 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.39 -43.81 88.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.269 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.65 -41.22 90.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.646 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.05 -45.4 87.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.356 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.03 -45.97 89.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.127 0.489 . . . . 0.0 110.272 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.479 HD13 ' CB ' ' A' ' 125' ' ' TYR . 41.6 mt -58.24 -41.6 84.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.63 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.545 ' CE2' HD11 ' A' ' 160' ' ' LEU . 47.0 t80 -59.52 -46.51 88.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.454 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.7 ttp -57.57 -45.03 85.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.44 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.08 -46.16 88.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.501 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.51 92.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.545 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.1 mt -56.42 -43.55 79.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.99 0.424 . . . . 0.0 110.625 -178.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.75 -46.23 89.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.222 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 33.0 mtp85 -56.69 -40.65 75.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -176.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.479 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.6 pt -87.97 13.98 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -175.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.63 19.57 79.84 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.358 -0.449 . . . . 0.0 113.289 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.417 ' HD2' HD11 ' A' ' 163' ' ' ILE . 84.1 mtt-85 -97.14 85.98 3.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.678 0.739 . . . . 0.0 110.138 176.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -68.33 -47.63 67.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.43 -176.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 84.5 p -56.04 -51.04 69.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.767 0.318 . . . . 0.0 111.181 -176.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.475 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.6 mt-10 -59.56 -39.45 84.1 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.894 -0.322 . . . . 0.0 110.974 -177.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.6 -47.81 82.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.331 . . . . 0.0 110.587 -177.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.48 -45.02 77.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.928 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.83 -49.86 75.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.284 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 49.3 t -57.73 -48.34 83.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.691 -178.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -53.82 -49.98 67.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.397 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -56.08 -39.64 72.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.941 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -58.61 -39.96 81.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.792 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.2 mt -58.69 -40.81 84.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.752 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -66.39 -41.61 89.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.723 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -146.59 142.9 28.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.623 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 82.4 t60 -106.18 131.27 53.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.448 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -133.75 177.38 7.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.49 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -96.41 142.01 29.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.492 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -102.94 139.26 38.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.604 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.565 179.984 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.3 m -132.55 154.83 40.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.585 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.95 134.91 34.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.61 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.1 t -119.08 136.13 57.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.936 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.4 m -60.04 113.02 2.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.488 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -73.78 -38.61 64.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.987 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.91 88.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.73 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.3 mmm -56.74 -50.18 73.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.849 0.357 . . . . 0.0 110.801 -178.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.72 -47.12 77.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.037 -178.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.95 -49.09 78.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.457 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.8 m -54.39 -52.29 62.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.95 0.405 . . . . 0.0 111.186 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -44.52 81.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.51 -40.52 91.73 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.679 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -58.34 -44.15 88.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.84 0.352 . . . . 0.0 110.409 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -61.02 -47.07 88.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.542 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.5 -46.23 89.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.676 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -59.49 -42.3 91.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.975 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.5 tttp -59.28 -46.52 88.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.079 0.466 . . . . 0.0 110.053 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -126.49 110.34 13.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.391 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.43 -11.95 26.74 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.13 14.91 14.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 18.9 t -108.13 94.81 13.78 Favored Pre-proline 0 CA--C 1.533 0.29 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.358 178.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -48.87 -34.66 29.08 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.37 1.38 . . . . 0.0 113.071 -174.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.09 -55.2 38.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.894 0.378 . . . . 0.0 110.584 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.09 -41.67 84.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.593 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.422 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.4 mm-40 -59.72 -45.89 90.8 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.351 -0.54 . . . . 0.0 109.675 -178.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.73 75.24 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 110.466 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.15 -44.37 92.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.311 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.36 -44.87 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 110.776 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.4 m-85 -57.61 -46.39 84.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.277 0.56 . . . . 0.0 110.054 -178.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -45.51 90.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.732 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.6 mt -58.55 -44.66 89.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.513 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -61.11 -40.97 95.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.926 -176.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.511 HD12 HD22 ' A' ' 155' ' ' LEU . 14.9 mt -64.33 -46.04 85.22 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.583 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.07 -40.59 85.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.7 0.286 . . . . 0.0 110.981 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 63.7 m -85.36 17.14 3.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 61.53 50.9 4.3 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.424 0.631 . . . . 0.0 110.751 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.591 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.266 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.25 -39.5 89.6 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.134 1.222 . . . . 0.0 111.707 -174.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.5 -38.41 69.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.935 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.83 -41.88 77.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.969 0.414 . . . . 0.0 110.169 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.55 -42.45 68.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.205 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.6 t -66.44 -52.88 41.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.676 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.8 m -54.46 -38.3 66.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.925 0.393 . . . . 0.0 111.24 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -72.44 -53.62 11.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.487 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -56.46 -31.69 64.24 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.81 -13.19 60.04 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.0 m -84.29 107.73 11.93 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.266 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -57.59 -14.78 17.96 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 121.224 1.282 . . . . 0.0 113.57 -174.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -22.98 77.19 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.932 -177.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -100.02 140.74 18.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 117.49 0.645 . . . . 0.0 110.301 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.422 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.93 156.1 21.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.754 -176.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -141.79 137.88 31.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.477 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 92.8 p -125.64 163.51 38.45 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.361 177.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -46.0 -44.96 18.37 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.445 1.43 . . . . 0.0 112.488 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -58.76 -44.05 90.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.275 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 60.4 m -59.59 -41.28 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.544 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.81 -45.1 86.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.435 -178.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -59.17 -46.12 89.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.191 0.519 . . . . 0.0 110.272 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.511 HD22 HD12 ' A' ' 129' ' ' LEU . 37.0 mt -58.73 -41.6 86.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.621 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.524 ' CE2' HD11 ' A' ' 160' ' ' LEU . 38.8 t80 -59.14 -46.37 88.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.164 0.507 . . . . 0.0 110.394 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.5 ttp -57.21 -44.56 83.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.527 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.78 -46.65 87.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.511 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.13 -44.0 92.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.279 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.8 mt -56.32 -43.35 78.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 110.672 -178.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.37 -46.35 88.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.242 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -57.38 -40.7 78.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.288 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 43.7 pt -89.05 14.06 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.99 24.45 75.81 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.467 -0.397 . . . . 0.0 113.141 173.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 55.6 mtp85 -97.12 91.0 5.35 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.515 0.658 . . . . 0.0 110.109 176.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -70.7 -44.75 66.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.55 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.6 t -55.99 -51.04 69.14 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.964 -0.295 . . . . 0.0 111.346 -174.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -62.51 -38.17 88.87 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.099 -176.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.92 -47.09 86.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.861 0.362 . . . . 0.0 110.466 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -56.16 -44.79 79.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.925 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.73 -48.57 79.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.23 -179.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.1 t -57.68 -47.64 85.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.589 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -53.22 -50.0 65.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.528 -178.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -56.47 -38.31 71.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.175 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -65.28 -41.97 93.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.213 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 81.5 mt -68.37 -38.85 81.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.155 -177.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -69.71 -39.17 77.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.126 -177.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -104.42 176.66 5.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.761 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -95.51 165.24 12.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.374 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -97.65 134.85 40.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.557 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -115.98 142.94 46.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -124.05 133.08 53.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.42 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.597 179.899 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.2 mtp . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.4 m -132.28 152.88 37.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.558 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.95 146.06 28.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.676 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -104.01 133.67 47.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 109.981 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.5 p -74.95 157.27 35.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.628 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -61.61 -36.68 81.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.308 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.08 89.25 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.935 -177.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.2 mtp -57.53 -48.06 80.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.801 0.334 . . . . 0.0 110.716 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.418 HD23 ' HB3' ' A' ' 127' ' ' LEU . 34.7 mt -55.36 -49.71 71.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 -178.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.07 79.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.487 -175.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.4 m -54.24 -52.83 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 111.26 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 87.4 mmt-85 -57.2 -44.24 83.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.89 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -60.26 -40.47 90.45 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.614 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -58.58 -45.63 88.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.837 0.351 . . . . 0.0 110.398 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.92 -46.82 89.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.616 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.77 90.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -59.0 -43.11 91.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.921 -177.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.71 -47.2 87.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.026 0.441 . . . . 0.0 110.177 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -121.54 108.76 13.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.392 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.0 mt -95.93 -11.88 25.95 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.19 14.92 14.76 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.6 t -108.63 94.87 14.96 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.332 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -48.86 -35.3 30.78 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.373 1.382 . . . . 0.0 113.05 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.56 -55.14 38.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.877 0.37 . . . . 0.0 110.653 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.67 83.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.563 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -59.67 -45.87 90.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.349 -0.541 . . . . 0.0 109.753 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.98 -46.76 75.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.976 0.417 . . . . 0.0 110.386 -176.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.22 92.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.216 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -59.16 -44.98 92.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.85 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.486 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.3 m-85 -57.65 -46.4 84.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.319 0.58 . . . . 0.0 110.093 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -58.73 -46.34 87.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.638 -178.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.418 ' HB3' HD23 ' A' ' 104' ' ' LEU . 42.5 mt -58.19 -44.08 87.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 -178.193 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.4 mt -60.98 -40.99 95.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.467 HD12 HD22 ' A' ' 155' ' ' LEU . 14.8 mt -64.36 -46.09 84.95 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.596 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.87 -40.3 83.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.736 0.303 . . . . 0.0 110.996 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -85.7 16.24 4.12 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 29.5 m120 61.93 51.03 3.89 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.462 0.648 . . . . 0.0 110.715 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.83 49.99 3.67 Favored Pre-proline 0 CA--C 1.541 0.613 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.297 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.414 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.5 Cg_endo -56.85 -38.92 94.76 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.18 1.253 . . . . 0.0 111.5 -175.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.12 -38.02 70.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.007 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -68.06 -42.24 80.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.986 0.422 . . . . 0.0 110.122 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.53 -42.38 68.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.17 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.69 -53.34 39.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 -177.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.9 m -54.65 -38.13 66.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.88 0.372 . . . . 0.0 111.212 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.86 -53.38 11.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.521 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -57.69 -30.53 65.56 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.876 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -76.89 -14.27 59.9 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -177.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.5 m -82.66 107.6 9.65 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.199 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.1 -16.98 29.53 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.19 1.26 . . . . 0.0 113.438 -174.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.38 77.01 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.314 -0.47 . . . . 0.0 113.011 -177.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.85 140.37 18.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.52 0.66 . . . . 0.0 110.401 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.7 156.08 24.62 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.621 0.724 . . . . 0.0 111.76 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.3 p -145.29 137.94 26.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.416 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.29 165.02 28.51 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.548 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -45.84 -44.41 18.34 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.467 1.445 . . . . 0.0 112.549 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -59.17 -43.53 92.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.187 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 81.7 m -59.6 -41.43 90.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.606 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.12 -45.71 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.409 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.68 -45.4 89.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.313 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.486 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.3 mt -58.28 -42.51 86.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.509 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -58.8 -45.78 89.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.5 ttp -57.16 -44.33 83.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.503 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -59.09 -46.97 86.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.445 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.47 -43.04 88.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.444 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.417 HD22 ' OE1' ' A' ' 168' ' ' GLU . 92.9 mt -56.8 -43.87 81.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.498 -178.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -45.73 90.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.15 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -56.04 -42.97 77.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.214 -176.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.454 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.2 pt -90.47 14.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -174.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.59 27.1 70.05 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.021 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.454 ' NE ' HD12 ' A' ' 163' ' ' ILE . 85.8 mtt180 -97.08 88.81 4.6 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 117.315 0.558 . . . . 0.0 110.156 175.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -69.04 -49.43 57.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.306 -177.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -55.97 -51.1 68.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.78 0.324 . . . . 0.0 111.174 -176.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.417 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.8 mt-10 -59.67 -39.59 84.99 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.923 -177.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.28 -47.41 84.47 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.485 -177.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -55.52 -45.45 77.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.879 0.371 . . . . 0.0 110.98 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.86 -49.36 76.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.214 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 47.6 t -58.97 -48.29 87.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.678 -178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 61.0 ttp85 -53.71 -45.29 70.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.396 -177.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -55.87 -39.74 71.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.944 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -64.03 -41.29 97.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.869 0.366 . . . . 0.0 110.554 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.56 -32.22 73.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.646 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -51.3 -35.23 36.78 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -60.88 151.18 30.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.729 0.3 . . . . 0.0 110.446 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -129.01 147.4 50.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.497 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -103.61 131.24 50.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.42 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -56.12 -39.32 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.02 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -95.03 148.47 22.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.644 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 49.9 m80 . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.405 179.74 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -135.83 141.64 41.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.333 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.65 148.11 50.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.565 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.4 p -133.92 143.86 37.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.158 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 t -83.29 113.0 20.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.64 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -74.7 -35.13 62.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.344 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.99 88.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.666 0.269 . . . . 0.0 110.856 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp -56.04 -49.23 74.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.817 0.342 . . . . 0.0 110.964 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.512 HD11 ' OG ' ' A' ' 131' ' ' SER . 14.5 mt -53.35 -52.02 60.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.205 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.06 75.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.795 -174.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -53.57 -54.07 42.7 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.598 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.594 ' HD2' HD11 ' A' ' 127' ' ' LEU . 85.5 mtt180 -63.2 -38.26 90.48 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.844 -177.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -60.85 -39.47 89.25 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.529 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -59.24 -47.74 84.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.852 0.358 . . . . 0.0 110.194 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.81 -44.84 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.577 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.04 -47.55 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.621 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -59.5 -41.39 89.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.079 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.19 -47.63 85.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.085 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -121.62 109.72 15.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.32 178.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -94.65 -11.85 28.5 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.2 p -92.1 15.03 14.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -108.74 94.91 15.25 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 119.262 -0.399 . . . . 0.0 110.282 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -48.88 -36.77 34.9 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.319 1.346 . . . . 0.0 113.03 -175.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -57.19 -54.09 50.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.689 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.34 85.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.59 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.5 mm-40 -59.49 -45.54 91.39 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.758 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.41 -46.69 73.22 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 110.471 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.6 92.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.93 -44.25 94.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.936 0.398 . . . . 0.0 110.858 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.495 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.2 m-85 -57.4 -45.97 83.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.324 0.583 . . . . 0.0 110.034 -179.061 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 32.9 mttm -59.16 -44.68 92.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.659 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.594 HD11 ' HD2' ' A' ' 107' ' ' ARG . 13.3 mt -58.06 -46.39 85.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.312 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.7 mt -60.04 -40.64 90.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.973 -175.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.479 HD12 HD22 ' A' ' 155' ' ' LEU . 16.6 mt -65.14 -46.16 82.09 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.692 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.03 -39.44 81.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.755 0.312 . . . . 0.0 111.092 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.512 ' OG ' HD11 ' A' ' 104' ' ' LEU . 63.9 m -86.92 16.97 4.39 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -176.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 62.27 50.27 3.92 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.458 0.646 . . . . 0.0 110.824 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -124.88 49.46 3.25 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.171 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.481 ' HB2' HG23 ' A' ' 163' ' ' ILE . 20.0 Cg_endo -57.58 -39.37 88.89 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.123 1.215 . . . . 0.0 111.544 -175.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -56.03 -37.64 69.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.047 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.98 79.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 0.0 110.12 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.35 -41.88 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.23 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.12 -53.2 43.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.498 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.67 -38.35 66.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 111.234 -176.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -72.99 -53.2 11.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.605 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -57.47 -30.77 65.34 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.791 -175.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -76.93 -12.79 60.0 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -84.36 107.41 10.89 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.661 -0.685 . . . . 0.0 110.294 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.13 -15.71 24.32 Favored 'Trans proline' 0 N--CA 1.502 1.978 0 C-N-CA 121.229 1.286 . . . . 0.0 113.549 -174.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -22.82 77.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 121.262 -0.494 . . . . 0.0 112.873 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -99.3 140.33 18.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 117.608 0.704 . . . . 0.0 110.36 -176.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.07 156.13 22.26 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.584 0.707 . . . . 0.0 111.79 -176.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.6 p -141.63 137.87 32.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.413 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.1 p -124.57 163.45 36.63 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.419 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -46.08 17.37 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 121.453 1.435 . . . . 0.0 112.307 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.18 -42.84 86.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.25 -42.44 95.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.56 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.42 ' CB ' HD21 ' A' ' 176' ' ' LEU . 23.6 mtp -57.99 -44.32 87.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.029 0.442 . . . . 0.0 110.456 -178.171 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -59.04 -46.19 88.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.191 0.519 . . . . 0.0 110.179 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.495 HD13 ' CB ' ' A' ' 125' ' ' TYR . 41.8 mt -57.7 -42.17 83.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.404 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.8 t80 -59.25 -46.62 88.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.429 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.4 ttp -57.39 -44.04 84.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.526 -178.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.43 -46.81 87.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.494 -178.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.97 89.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.067 0.461 . . . . 0.0 110.465 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.457 HD22 ' OE1' ' A' ' 168' ' ' GLU . 92.8 mt -56.4 -43.74 79.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.61 -45.85 90.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.209 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -56.14 -41.52 75.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.256 -177.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.481 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.4 pt -88.51 14.19 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.53 22.2 79.1 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 121.373 -0.442 . . . . 0.0 113.206 174.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -97.1 85.97 3.85 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 117.58 0.69 . . . . 0.0 110.189 176.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -68.25 -46.92 69.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.296 -177.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 22.6 m -56.02 -51.08 69.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.79 0.329 . . . . 0.0 111.136 -176.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.457 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.1 mt-10 -59.47 -39.22 83.0 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.968 -177.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.23 -47.88 82.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.8 0.333 . . . . 0.0 110.538 -177.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -55.64 -44.59 77.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.991 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.99 -49.52 76.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.221 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 52.2 t -57.19 -48.5 82.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.636 -178.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -54.29 -50.13 68.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.199 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -56.56 -40.52 75.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.818 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -60.54 -37.84 82.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.115 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.42 HD21 ' CB ' ' A' ' 153' ' ' MET . 25.3 mt -74.42 140.94 45.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.88 0.371 . . . . 0.0 110.756 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -128.88 128.57 44.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.274 179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -141.57 166.23 25.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.65 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -98.63 138.97 35.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.408 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -80.29 99.97 8.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.643 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -67.05 -40.81 87.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.739 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -78.68 136.73 37.52 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.567 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.574 -179.991 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 44.3 ttm . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.8 t -106.61 132.94 52.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.021 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.36 140.54 55.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.584 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -125.09 133.9 68.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.219 -0.446 . . . . 0.0 109.922 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 53.8 m -93.97 149.15 21.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.622 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -59.41 -35.53 74.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.333 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.96 -38.55 79.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.68 0.276 . . . . 0.0 110.958 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.8 mtp -56.31 -45.19 80.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.8 mt -56.39 -47.85 78.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.818 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.4 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.297 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.48 -53.06 56.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.891 0.377 . . . . 0.0 111.329 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -56.35 -44.47 80.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.076 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.56 -40.43 91.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.644 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -58.16 -44.4 87.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.383 . . . . 0.0 110.435 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.64 -47.53 85.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.439 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.29 -46.04 89.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.658 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -59.05 -42.58 90.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.88 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.25 -46.81 87.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.091 0.472 . . . . 0.0 110.07 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -124.42 108.67 12.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.262 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.415 HD22 HG12 ' A' ' 146' ' ' ILE . 90.6 mt -94.84 -11.85 28.07 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.9 15.01 13.97 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 16.7 t -108.83 94.92 15.47 Favored Pre-proline 0 CA--C 1.533 0.314 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.283 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -48.93 -34.96 30.34 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.344 1.362 . . . . 0.0 112.889 -175.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -57.68 -54.86 42.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.908 0.385 . . . . 0.0 110.672 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.95 84.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.557 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.435 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.0 mm-40 -59.42 -45.3 91.92 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.812 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.93 -47.46 74.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.911 0.386 . . . . 0.0 110.388 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.39 92.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.338 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -58.92 -44.9 91.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.462 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.4 m-85 -57.72 -46.47 84.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.338 0.589 . . . . 0.0 110.188 -178.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.619 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.6 mt -58.39 -44.31 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.496 -178.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.7 mt -61.48 -41.21 96.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.03 -176.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 155' ' ' LEU . 20.1 mt -64.17 -46.16 85.22 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -59.08 -40.66 85.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.107 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.2 m -84.82 16.12 3.52 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 61.76 51.14 3.99 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.547 0.689 . . . . 0.0 110.676 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.83 49.36 3.15 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.302 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.516 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.2 Cg_endo -56.63 -39.85 88.47 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.144 1.23 . . . . 0.0 111.588 -175.085 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -55.71 -38.22 69.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.065 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.26 -42.66 79.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.031 0.443 . . . . 0.0 110.094 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.39 -42.84 69.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.158 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.13 -52.09 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.578 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -54.57 -38.23 66.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.923 0.392 . . . . 0.0 111.259 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.2 ttt85 -72.57 -53.84 10.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.576 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -56.72 -31.28 64.36 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.59 59.99 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.6 m -83.7 107.54 10.58 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.214 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -57.78 -16.26 24.63 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 121.266 1.311 . . . . 0.0 113.573 -174.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.62 77.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.972 -177.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.415 HG12 HD22 ' A' ' 115' ' ' LEU . 73.0 mt -99.62 139.76 20.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 117.524 0.662 . . . . 0.0 110.34 -176.181 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.435 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.72 156.06 17.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.673 0.749 . . . . 0.0 111.635 -177.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.7 p -149.14 137.88 21.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.399 176.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 p -124.9 165.03 27.74 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.442 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -45.97 -44.77 18.45 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.472 1.448 . . . . 0.0 112.48 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -58.07 -44.47 87.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.987 0.422 . . . . 0.0 110.289 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.5 m -59.11 -41.41 88.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 24.3 mtp -57.71 -43.57 85.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.456 -178.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.71 -46.26 87.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.121 0.486 . . . . 0.0 110.169 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.462 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.5 mt -58.54 -41.9 86.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.532 ' CE2' HD11 ' A' ' 160' ' ' LEU . 47.9 t80 -58.75 -45.67 89.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.174 0.511 . . . . 0.0 110.358 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.411 ' HB2' HG11 ' A' ' 172' ' ' VAL . 59.7 ttp -58.62 -44.25 89.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.586 -179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.59 -45.74 88.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.47 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.4 91.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.345 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.532 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.6 mt -56.33 -42.9 78.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.689 -178.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.14 -46.85 87.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.214 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 22.0 mtp85 -56.12 -41.84 75.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.236 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.516 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.5 pt -88.39 13.95 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 70.24 24.18 76.81 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.398 -0.429 . . . . 0.0 113.056 174.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 -97.02 85.95 3.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 117.47 0.635 . . . . 0.0 110.287 176.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -67.08 -47.17 72.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.319 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 21.1 m -56.01 -50.95 69.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.861 0.362 . . . . 0.0 111.173 -176.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.428 ' OE1' HD22 ' A' ' 160' ' ' LEU . 92.9 mt-10 -60.26 -38.17 82.67 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.913 -177.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -60.67 -47.82 84.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.143 0.497 . . . . 0.0 110.2 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -55.44 -42.45 74.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.975 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.9 -48.75 78.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.021 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.411 HG11 ' HB2' ' A' ' 157' ' ' MET . 46.6 t -55.79 -46.13 79.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.566 0.222 . . . . 0.0 110.69 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -52.98 -49.97 65.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.786 0.326 . . . . 0.0 111.308 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.05 -39.81 72.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.891 179.078 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -60.25 -39.64 87.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.82 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.0 mt -79.1 136.54 37.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.431 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -146.53 -56.98 0.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.79 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -111.76 127.12 55.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.676 -178.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -149.97 105.85 3.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.492 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -150.01 -69.27 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.688 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -98.33 -40.41 8.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.784 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -60.58 143.42 53.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.591 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.685 -179.806 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.7 ttm . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.434 HG23 ' N ' ' A' ' 98' ' ' ALA . 35.3 m -123.35 -39.71 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.72 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.434 ' N ' HG23 ' A' ' 97' ' ' VAL . . . -66.63 146.61 54.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.546 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.7 m -130.19 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.362 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 79.4 p -91.82 151.05 20.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.654 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -78.92 -24.81 43.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.034 -0.53 . . . . 0.0 112.347 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.93 -38.54 79.19 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.629 0.252 . . . . 0.0 110.936 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 73.3 mtm -56.35 -46.56 79.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.891 0.377 . . . . 0.0 110.787 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.7 mt -56.43 -47.0 79.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.8 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.0 79.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.237 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.37 -53.24 53.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.907 0.384 . . . . 0.0 111.404 -178.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 83.1 mmt-85 -56.57 -44.09 80.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.055 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -60.43 -40.63 91.76 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.581 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.94 -43.96 86.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.97 0.414 . . . . 0.0 110.439 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -60.77 -47.91 84.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.478 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.12 -45.7 90.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.636 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -59.04 -42.88 91.3 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.819 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -59.29 -46.51 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.076 0.465 . . . . 0.0 109.991 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -125.68 109.08 12.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.386 177.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -95.27 -11.9 27.13 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -91.33 14.86 13.34 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.2 t -108.78 94.79 15.08 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-O 119.273 -0.394 . . . . 0.0 110.244 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.8 -34.75 28.89 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.302 1.335 . . . . 0.0 113.037 -175.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -57.71 -55.15 38.61 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.665 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.34 83.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.495 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.407 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.9 mm-40 -59.64 -46.09 90.04 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.668 -179.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.75 -46.82 74.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.95 0.405 . . . . 0.0 110.434 -176.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.52 -44.47 93.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.278 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.85 -44.95 91.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.489 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.8 m-85 -57.85 -46.62 84.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.267 0.556 . . . . 0.0 110.045 -178.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -58.63 -45.44 89.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.43 -44.97 89.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.553 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.15 -40.62 94.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.884 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.473 HD12 HD22 ' A' ' 155' ' ' LEU . 16.3 mt -64.34 -46.09 85.01 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.619 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -58.69 -40.93 85.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.015 -177.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.61 16.1 3.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 62.0 50.58 4.04 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.431 0.634 . . . . 0.0 110.78 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.85 49.4 3.19 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.167 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.507 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.9 Cg_endo -57.61 -38.55 93.17 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.091 1.194 . . . . 0.0 111.688 -174.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.09 -38.19 70.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.0 -42.5 80.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.017 0.437 . . . . 0.0 110.081 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.0 t -55.53 -42.81 69.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.204 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.92 -52.34 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.54 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.6 67.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 111.157 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.2 -53.19 13.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.55 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -56.55 -32.5 65.2 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.656 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -76.85 -11.34 59.81 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -85.01 107.34 11.35 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-O 118.753 -0.641 . . . . 0.0 110.253 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.79 -15.64 22.19 Favored 'Trans proline' 0 N--CA 1.502 1.998 0 C-N-CA 121.26 1.307 . . . . 0.0 113.499 -174.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.85 -22.6 77.01 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.972 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.7 mt -99.99 140.29 19.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.515 0.657 . . . . 0.0 110.339 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.407 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.7 156.1 17.61 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.593 0.711 . . . . 0.0 111.722 -176.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.81 137.88 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.465 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 95.8 p -125.98 163.35 40.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.391 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.02 -45.37 17.78 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.446 1.43 . . . . 0.0 112.422 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -58.26 -43.2 87.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.962 0.41 . . . . 0.0 110.369 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.4 m -59.98 -41.87 92.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.462 ' HB3' HD21 ' A' ' 176' ' ' LEU . 23.3 mtp -57.91 -44.8 87.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.964 0.411 . . . . 0.0 110.403 -178.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.81 -45.75 89.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.303 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.489 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.5 mt -58.62 -40.91 84.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.615 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.556 ' CE2' HD11 ' A' ' 160' ' ' LEU . 53.2 t80 -59.46 -47.41 85.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.106 0.479 . . . . 0.0 110.495 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.1 ttp -57.65 -44.54 85.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.459 -178.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.26 -45.88 90.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.459 -177.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.95 -43.82 91.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.137 0.494 . . . . 0.0 110.496 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.556 HD11 ' CE2' ' A' ' 156' ' ' TYR . 92.8 mt -56.58 -43.29 79.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.535 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.83 -46.07 90.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.308 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -56.39 -40.81 75.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.225 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.507 HG23 ' HB2' ' A' ' 134' ' ' PRO . 39.6 pt -87.53 13.99 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.184 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.65 17.64 80.04 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 121.326 -0.464 . . . . 0.0 113.429 174.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt-85 -97.14 86.01 3.84 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 117.704 0.752 . . . . 0.0 110.097 176.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -71.99 -44.56 63.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.218 -176.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -56.14 -50.93 69.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 111.093 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.458 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.2 mt-10 -59.08 -41.08 87.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.948 -177.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.0 -47.55 84.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.67 -177.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.51 -45.57 77.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.956 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.92 -49.27 77.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.307 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.405 HG21 ' CE2' ' A' ' 156' ' ' TYR . 51.6 t -57.23 -50.53 76.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.735 -178.224 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 173' ' ' ARG . . . . . 0.442 ' HA ' HD12 ' A' ' 176' ' ' LEU . 76.2 ttt180 -54.11 -49.98 67.91 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.733 0.301 . . . . 0.0 111.319 -177.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -58.27 -37.95 76.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.008 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -65.21 -32.87 74.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.769 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.462 HD21 ' HB3' ' A' ' 153' ' ' MET . 79.5 mt -57.16 -58.79 6.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.67 0.272 . . . . 0.0 111.422 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -78.49 -46.16 20.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.461 -176.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -55.04 -43.03 73.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.188 -177.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 69.9 m80 -102.81 152.29 21.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.615 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -73.19 154.62 40.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.581 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -56.95 -43.96 82.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.695 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 34.5 t-80 -61.4 -45.72 93.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.58 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.596 179.941 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.9 ttm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.4 m -132.55 154.87 40.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.517 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.45 134.61 35.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.593 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.5 m -131.29 151.0 34.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.46 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.2 p -93.95 153.34 18.26 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.636 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -59.14 -31.0 68.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.716 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.97 -40.8 85.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.686 0.279 . . . . 0.0 110.78 -178.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.9 mtp -57.09 -48.4 78.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.014 0.435 . . . . 0.0 110.65 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.0 mt -56.36 -44.55 80.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.739 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.2 m -53.48 -53.63 48.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.856 0.36 . . . . 0.0 111.306 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -56.47 -44.13 80.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.021 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -60.6 -40.56 92.23 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.657 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -57.94 -44.14 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.408 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.89 -48.0 83.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.568 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.75 90.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.686 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -60.27 -44.05 95.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.919 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -58.9 -45.23 90.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.059 0.457 . . . . 0.0 110.127 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -126.41 107.69 10.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.324 177.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.5 mt -95.03 -11.94 27.5 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.2 p -91.68 15.06 13.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -107.85 94.87 13.3 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 119.284 -0.388 . . . . 0.0 110.151 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -48.85 -34.43 28.26 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.413 1.408 . . . . 0.0 113.056 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -58.24 -55.21 37.98 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.587 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.41 82.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.609 -179.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.408 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.1 mm-40 -59.71 -46.36 89.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.756 -179.132 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.69 -46.79 74.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.921 0.391 . . . . 0.0 110.486 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.32 -45.21 91.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.263 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -59.13 -43.95 91.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.897 -178.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.497 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.8 m-85 -57.58 -46.23 84.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 110.15 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -59.05 -44.85 91.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.678 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.54 -45.28 89.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.528 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.9 mt -60.44 -41.11 93.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.5 HD12 HD22 ' A' ' 155' ' ' LEU . 16.3 mt -64.05 -46.15 85.64 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.666 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -58.85 -40.34 83.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.756 0.313 . . . . 0.0 111.147 -177.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.4 m -84.49 15.61 3.62 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 62.14 50.53 3.93 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.463 0.649 . . . . 0.0 110.727 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.93 49.44 3.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.228 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.486 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.1 Cg_endo -57.15 -39.67 88.88 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.135 1.224 . . . . 0.0 111.673 -175.029 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -55.46 -38.03 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.995 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.46 -42.42 78.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.943 0.402 . . . . 0.0 110.135 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.2 t -55.37 -42.25 66.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.25 -52.45 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.552 -177.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.74 -38.62 67.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 0.0 111.204 -176.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.1 ttt85 -72.21 -53.31 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.531 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -56.58 -31.6 64.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 -176.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -76.89 -12.62 59.98 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.4 m -84.66 107.44 11.33 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.149 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.91 -14.83 19.62 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 C-N-CA 121.232 1.288 . . . . 0.0 113.581 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -23.03 77.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 121.196 -0.526 . . . . 0.0 112.906 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -99.85 140.16 19.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 117.446 0.623 . . . . 0.0 110.235 -176.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.408 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.36 156.1 19.81 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.507 0.67 . . . . 0.0 111.65 -177.147 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.4 p -144.19 137.93 27.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.404 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.11 165.12 29.36 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.477 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -45.94 -44.31 18.85 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.442 1.428 . . . . 0.0 112.474 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -58.43 -44.86 89.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.962 0.41 . . . . 0.0 110.258 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.2 m -59.1 -41.62 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.458 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.77 -45.74 85.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.956 0.408 . . . . 0.0 110.39 -178.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -58.83 -45.67 89.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.216 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.5 HD22 HD12 ' A' ' 129' ' ' LEU . 38.1 mt -58.77 -41.06 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.68 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.562 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.3 t80 -59.53 -47.33 85.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.129 0.49 . . . . 0.0 110.456 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.6 ttp -57.53 -44.14 84.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.451 -178.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -59.3 -46.38 88.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.565 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.121 0.486 . . . . 0.0 110.415 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.562 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.8 mt -56.48 -43.25 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.642 -178.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.91 -46.27 89.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.379 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -56.41 -40.47 74.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.241 -177.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.486 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.0 pt -87.49 13.98 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 113.456 0.909 . . . . 0.0 113.456 -175.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 78.61 15.26 81.1 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 121.322 -0.466 . . . . 0.0 113.506 174.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.433 ' HD2' HD11 ' A' ' 163' ' ' ILE . 86.8 mtt-85 -97.11 85.92 3.83 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.777 0.789 . . . . 0.0 110.144 177.34 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -72.87 -44.81 60.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.28 -176.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -56.03 -50.95 69.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.808 0.337 . . . . 0.0 111.1 -176.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.525 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.0 mt-10 -59.17 -39.14 81.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.933 -177.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.1 -48.06 81.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.882 0.372 . . . . 0.0 110.582 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -55.67 -44.8 77.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.939 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.91 -49.58 76.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.244 -179.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 53.8 t -56.94 -48.2 81.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.991 -0.283 . . . . 0.0 110.677 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -54.02 -49.98 67.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.698 0.285 . . . . 0.0 111.258 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -56.94 -39.4 74.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.845 178.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -56.98 -38.53 73.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.006 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 79.4 mt -64.79 88.03 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.789 0.328 . . . . 0.0 110.497 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -72.25 -38.52 68.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.016 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -93.86 145.74 24.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.828 0.346 . . . . 0.0 110.709 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -108.07 150.59 26.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.383 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -78.67 100.1 6.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.562 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -91.5 -42.71 10.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.775 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -110.35 143.21 40.93 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.483 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.54 179.937 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.2 mtm . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.8 t -109.15 133.83 53.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.019 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.58 148.27 52.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.56 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.4 t -99.88 134.32 39.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.024 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.5 m -67.19 140.45 57.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -65.21 -30.38 71.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.835 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -35.66 73.56 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.468 0.175 . . . . 0.0 111.365 -177.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.1 mtp -55.89 -48.88 74.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.933 0.397 . . . . 0.0 110.85 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.6 mt -56.59 -44.4 81.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.759 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.04 79.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.334 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.31 -53.25 53.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.998 0.428 . . . . 0.0 111.346 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -56.86 -45.6 82.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.926 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -59.88 -39.28 84.76 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.761 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -58.06 -45.14 87.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.91 0.386 . . . . 0.0 110.336 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -60.29 -48.07 83.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.362 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.03 -45.87 89.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.603 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -59.32 -42.25 90.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -59.02 -46.33 88.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.022 0.439 . . . . 0.0 110.073 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -127.07 110.91 13.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.495 177.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 96.5 mt -94.13 -11.87 29.6 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 178.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.29 15.08 12.73 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.9 t -108.13 94.79 13.72 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.332 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.93 -39.09 39.85 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.381 1.387 . . . . 0.0 113.14 -175.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -56.81 -51.71 67.91 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.825 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.38 -42.99 92.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.568 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -59.3 -45.19 91.97 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.76 -179.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.22 -47.21 72.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.978 0.418 . . . . 0.0 110.454 -176.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.46 -44.93 92.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.21 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -58.76 -44.51 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 0.0 110.839 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.493 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.1 m-85 -57.65 -46.8 83.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.277 0.561 . . . . 0.0 110.041 -178.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -58.56 -46.04 87.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.697 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.31 -44.22 88.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.571 -178.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.3 mt -60.79 -41.28 95.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.866 -176.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.464 HD12 HD22 ' A' ' 155' ' ' LEU . 16.4 mt -64.47 -46.17 84.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.742 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -59.17 -39.82 83.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.056 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 73.6 m -84.76 15.4 3.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 62.46 50.1 3.81 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.499 0.666 . . . . 0.0 110.869 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -124.88 48.91 2.82 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.421 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.86 -38.27 93.17 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.147 1.231 . . . . 0.0 111.643 -175.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -56.22 -38.21 70.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.01 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.06 -42.12 80.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.044 0.45 . . . . 0.0 110.109 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.62 -43.25 72.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.145 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 45.8 t -65.95 -52.21 51.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.6 -177.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -55.02 -39.06 68.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.831 0.348 . . . . 0.0 111.092 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -72.36 -51.95 18.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.547 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -57.0 -31.62 65.28 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -76.89 -10.06 59.11 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 12.7 m -86.26 106.87 11.22 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.211 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -57.64 -15.0 18.85 Favored 'Trans proline' 0 N--CA 1.5 1.898 0 C-N-CA 121.311 1.341 . . . . 0.0 113.571 -174.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -23.25 77.11 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 121.286 -0.483 . . . . 0.0 112.872 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -98.64 139.77 19.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 117.542 0.671 . . . . 0.0 110.385 -176.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.14 156.1 19.04 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.665 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -144.6 137.84 27.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.515 176.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.86 164.97 29.86 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.414 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -45.81 -43.35 19.29 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 121.454 1.436 . . . . 0.0 112.488 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -59.88 -43.93 94.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.098 178.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.1 m -59.65 -41.46 90.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.572 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.3 mtp -58.13 -45.47 87.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.979 0.419 . . . . 0.0 110.342 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.51 -45.29 89.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.204 0.526 . . . . 0.0 110.231 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.493 HD13 ' CB ' ' A' ' 125' ' ' TYR . 38.7 mt -59.28 -41.22 88.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.611 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.541 ' CE2' HD11 ' A' ' 160' ' ' LEU . 49.1 t80 -58.08 -45.2 87.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.07 0.462 . . . . 0.0 110.218 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 16.5 ttm -57.74 -45.91 85.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -57.81 -45.26 86.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.513 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.75 91.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.969 0.414 . . . . 0.0 110.306 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.541 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.1 mt -56.59 -43.34 80.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.037 0.446 . . . . 0.0 110.532 -178.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.5 -44.39 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.391 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 18.0 mtp180 -56.42 -42.67 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.44 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.8 pt -88.49 14.15 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -174.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.9 23.34 69.57 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.276 -0.487 . . . . 0.0 113.305 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.44 ' NE ' HD12 ' A' ' 163' ' ' ILE . 92.5 mtt180 -97.11 85.99 3.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 117.448 0.624 . . . . 0.0 110.172 175.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -67.9 -49.85 59.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.282 -176.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.2 m -55.89 -51.12 68.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.738 0.304 . . . . 0.0 111.301 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.519 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.7 mt-10 -59.43 -40.73 87.68 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.049 -176.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.16 -47.41 84.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.847 0.356 . . . . 0.0 110.667 -177.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -55.63 -45.32 77.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.962 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.92 -50.09 74.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.325 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.1 t -57.48 -49.02 81.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.672 -177.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -54.61 -49.86 69.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.254 -178.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.03 -39.3 71.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.076 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -58.27 -40.34 81.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.828 0.347 . . . . 0.0 110.771 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.1 -38.65 87.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.933 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -56.63 -38.93 72.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.944 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -100.33 174.25 6.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.833 0.349 . . . . 0.0 110.578 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.2 m80 -95.35 167.5 11.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.567 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -95.04 134.62 37.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.484 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -57.61 -61.09 2.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.739 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 21.7 m80 -150.03 136.2 18.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.676 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.505 179.861 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.2 t -106.81 133.27 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.019 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.07 135.59 36.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.562 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.6 p -137.17 141.32 40.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.211 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 42.6 t -94.04 137.81 32.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.636 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -64.51 -36.84 85.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.229 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.49 84.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.762 0.315 . . . . 0.0 110.76 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.8 mtt -56.79 -43.61 81.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.836 0.35 . . . . 0.0 110.751 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.6 mt -56.18 -49.65 73.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.824 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.0 -49.05 79.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.249 -176.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.4 m -53.4 -53.02 57.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.393 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -56.37 -44.3 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.992 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.04 -41.73 92.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.609 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -58.31 -44.03 88.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.79 0.329 . . . . 0.0 110.437 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.16 -47.12 87.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.547 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.52 -46.22 89.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.593 -179.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -59.7 -41.91 91.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -59.5 -46.88 87.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.134 0.492 . . . . 0.0 109.977 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -123.54 106.3 10.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.197 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -93.44 -12.0 30.81 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.26 15.0 14.66 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.6 t -108.03 94.84 13.6 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.351 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -48.75 -34.79 28.69 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.432 1.421 . . . . 0.0 113.155 -174.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.59 -54.91 41.77 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.621 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.1 83.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.53 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.46 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.1 mm-40 -59.77 -46.84 87.93 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.694 -178.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.79 -46.84 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.925 0.393 . . . . 0.0 110.518 -176.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.27 -44.68 92.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.65 -44.22 93.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.922 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.491 ' CB ' HD13 ' A' ' 155' ' ' LEU . 66.7 m-85 -57.65 -46.23 84.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.321 0.582 . . . . 0.0 110.117 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -59.3 -45.14 92.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.679 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.7 mt -59.05 -44.75 91.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.6 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.0 mt -61.11 -41.11 96.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.912 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.535 HD12 HD22 ' A' ' 155' ' ' LEU . 14.4 mt -64.17 -46.05 85.71 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.634 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.15 -40.57 85.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.713 0.292 . . . . 0.0 110.931 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.9 m -84.36 16.31 3.15 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 61.78 50.62 4.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.477 0.656 . . . . 0.0 110.842 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.86 48.58 2.64 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.58 -39.46 88.13 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 121.109 1.206 . . . . 0.0 111.773 -174.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -55.55 -38.21 68.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.04 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.37 -42.86 78.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.019 0.438 . . . . 0.0 109.992 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.3 t -55.3 -42.63 67.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.307 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.7 t -67.05 -53.62 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.716 -176.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 21.6 t -54.83 -39.37 68.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.973 0.416 . . . . 0.0 111.153 -176.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.6 ttt-85 -72.98 -50.47 23.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.692 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.6 -32.84 65.65 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.584 -177.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -76.93 -7.55 55.76 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -177.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 39.2 m -86.67 106.73 11.31 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.105 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_exo -57.42 -13.96 14.8 Favored 'Trans proline' 0 N--CA 1.502 2.002 0 C-N-CA 121.234 1.289 . . . . 0.0 113.667 -174.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -24.13 76.58 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.252 -0.499 . . . . 0.0 112.857 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.2 mt -98.01 142.04 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 117.386 0.593 . . . . 0.0 110.397 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.46 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.27 156.21 26.21 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.554 -177.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.1 p -146.19 137.86 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.543 176.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -123.56 165.09 24.64 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.365 177.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.91 -44.97 18.02 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.439 1.426 . . . . 0.0 112.509 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.44 -43.31 88.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.318 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.0 m -60.11 -42.86 95.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.865 0.364 . . . . 0.0 110.589 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.6 ' SD ' HD21 ' A' ' 176' ' ' LEU . 23.5 mtp -57.97 -43.4 86.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.441 -178.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -59.04 -46.45 88.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.146 0.498 . . . . 0.0 110.083 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.535 HD22 HD12 ' A' ' 129' ' ' LEU . 35.6 mt -58.52 -41.0 84.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.647 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.505 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 38.7 t80 -58.81 -45.35 90.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.084 0.469 . . . . 0.0 110.387 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 15.1 ttm -57.92 -45.82 85.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.407 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -57.84 -45.49 86.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.521 -176.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.15 -45.73 92.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.979 0.419 . . . . 0.0 110.402 -178.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.505 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 90.4 mt -56.65 -42.68 79.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.005 0.431 . . . . 0.0 110.629 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -60.99 -45.37 95.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.408 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.3 mtp180 -56.63 -41.36 77.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.114 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -87.44 13.99 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.89 21.36 79.84 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.428 -0.415 . . . . 0.0 113.265 173.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -97.02 85.91 3.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 117.626 0.713 . . . . 0.0 110.146 176.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -70.06 -46.39 65.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.351 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 85.8 p -56.06 -50.95 69.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.793 0.33 . . . . 0.0 111.127 -175.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.491 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.2 mt-10 -59.24 -39.45 82.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.918 -177.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.23 -47.74 83.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.83 0.348 . . . . 0.0 110.633 -177.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -55.28 -45.26 76.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.99 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.85 -49.54 76.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.155 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 51.2 t -57.03 -48.56 81.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 120.936 -0.305 . . . . 0.0 110.701 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -53.9 -50.02 67.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 111.332 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -56.63 -39.78 74.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.869 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -57.07 -36.83 71.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.136 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.6 HD21 ' SD ' ' A' ' 153' ' ' MET . 81.7 mt -77.9 123.6 26.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.778 0.323 . . . . 0.0 110.79 -179.135 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 40.1 mp0 -85.86 -41.54 14.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.611 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -111.25 146.41 37.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.696 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 59.1 t60 -137.11 137.19 39.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.436 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -103.81 133.67 48.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.576 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -58.23 -40.6 82.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.733 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -79.91 144.32 33.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.564 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.581 -179.872 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.1 t -116.41 132.08 67.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.927 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.8 145.31 55.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.525 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 99' ' ' VAL . 22.4 m -91.42 123.02 43.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.649 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.9 t -93.97 146.25 24.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.739 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -54.84 -35.28 63.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.292 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.95 -34.26 71.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.392 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.2 mtt -55.2 -44.97 75.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.921 0.391 . . . . 0.0 110.943 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.2 mt -56.49 -47.65 78.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.745 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -48.98 79.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.121 -177.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.03 -53.2 53.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.892 0.377 . . . . 0.0 111.474 -178.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 82.7 mmt-85 -56.28 -44.51 79.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.954 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -60.34 -39.93 88.87 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.68 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.99 -44.14 87.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.976 0.417 . . . . 0.0 110.389 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -60.88 -47.43 86.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.526 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.36 -45.39 91.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.664 -179.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.32 -42.83 92.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.905 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -59.51 -47.08 86.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.087 0.47 . . . . 0.0 109.982 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.4 108.81 12.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.302 177.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.9 mt -95.92 -11.92 25.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.33 14.76 13.62 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.0 t -108.53 94.78 14.55 Favored Pre-proline 0 CA--C 1.533 0.294 0 O-C-N 122.042 -0.411 . . . . 0.0 110.183 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.86 -34.37 28.12 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.431 1.421 . . . . 0.0 112.894 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.13 -55.33 36.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.816 0.341 . . . . 0.0 110.679 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.02 81.62 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.569 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.436 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.7 mm-40 -59.85 -46.46 89.22 Favored 'General case' 0 N--CA 1.461 0.12 0 C-N-CA 120.382 -0.527 . . . . 0.0 109.672 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.47 74.09 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.936 0.398 . . . . 0.0 110.506 -176.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.99 92.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.247 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -58.72 -45.01 90.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 110.869 -179.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.481 ' CB ' HD13 ' A' ' 155' ' ' LEU . 66.1 m-85 -57.64 -46.55 84.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.371 0.605 . . . . 0.0 110.104 -178.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.5 mttt -58.82 -45.59 89.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.757 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.8 mt -58.47 -44.47 89.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.522 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.16 -41.13 96.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.959 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.497 HD12 HD22 ' A' ' 155' ' ' LEU . 13.8 mt -64.1 -46.07 85.85 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.492 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.53 -41.44 85.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.738 0.304 . . . . 0.0 111.0 -177.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.52 16.11 3.35 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 61.88 51.18 3.87 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.474 0.654 . . . . 0.0 110.695 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -124.91 49.77 3.53 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.116 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.406 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.8 Cg_endo -56.42 -39.87 88.39 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 121.183 1.256 . . . . 0.0 111.575 -175.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.57 -38.1 68.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.114 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.32 -42.4 79.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.07 0.462 . . . . 0.0 110.117 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.75 -42.47 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.185 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.0 t -66.23 -52.19 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -177.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -54.54 -38.15 66.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.0 111.23 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.7 ttt85 -72.89 -53.94 10.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.499 -178.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -56.64 -31.21 64.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.35 60.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -84.67 107.06 9.98 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.207 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -58.16 -15.22 22.31 Favored 'Trans proline' 0 N--CA 1.501 1.912 0 C-N-CA 121.31 1.34 . . . . 0.0 113.571 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -23.55 76.99 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 121.305 -0.474 . . . . 0.0 112.856 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.9 mt -98.15 139.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 117.529 0.664 . . . . 0.0 110.362 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.436 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.32 156.05 16.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.693 0.759 . . . . 0.0 111.594 -176.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -143.33 137.95 29.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.348 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.5 p -125.35 163.48 38.07 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.304 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -45.96 -45.11 17.97 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 121.378 1.385 . . . . 0.0 112.476 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -58.36 -43.97 88.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.317 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.81 -41.5 91.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -57.91 -44.94 87.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.954 0.407 . . . . 0.0 110.442 -178.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.95 -46.22 88.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.248 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.497 HD22 HD12 ' A' ' 129' ' ' LEU . 40.6 mt -58.26 -40.83 82.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.678 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.52 ' CE2' HD11 ' A' ' 160' ' ' LEU . 43.1 t80 -59.37 -47.62 84.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.415 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.2 ttp -57.43 -42.93 83.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' GLU . . . . . 0.435 ' OE1' HD13 ' A' ' 129' ' ' LEU . 92.4 mt-10 -59.22 -47.38 85.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.543 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.77 -43.45 90.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.019 0.437 . . . . 0.0 110.364 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.52 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.7 mt -56.68 -43.77 80.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.588 -178.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.3 -46.04 89.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.151 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.4 mtp85 -56.42 -42.19 77.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.284 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.421 HD12 ' NE ' ' A' ' 165' ' ' ARG . 38.3 pt -89.47 14.16 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -174.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.65 25.59 69.56 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.309 -0.472 . . . . 0.0 113.154 173.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.421 ' NE ' HD12 ' A' ' 163' ' ' ILE . 87.9 mtt180 -97.06 89.01 4.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 117.448 0.624 . . . . 0.0 110.109 175.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -68.45 -51.14 46.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.379 -176.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.2 t -55.98 -51.06 69.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 0.0 111.214 -175.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.468 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.5 mt-10 -59.51 -40.8 88.27 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.986 -176.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.98 -46.94 87.06 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.618 -177.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.34 -45.97 76.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.981 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.96 -49.61 76.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.359 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.09 -48.83 83.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.746 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 70.6 ttp85 -54.14 -48.43 70.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.283 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -55.93 -39.77 72.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.947 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -61.41 -40.99 96.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.68 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.5 mt -62.82 -40.35 97.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.792 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -60.61 -41.49 94.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.737 -179.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -148.18 141.74 25.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.63 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -95.86 147.11 24.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.561 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -120.86 157.23 30.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.433 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -56.84 -40.52 76.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.737 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -84.25 145.57 28.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.493 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.535 -179.834 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.2 mtm . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.9 t -110.52 134.22 53.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.253 -0.431 . . . . 0.0 109.993 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.34 149.61 50.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.541 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.73 151.05 34.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.5 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 74.8 m -63.71 119.71 10.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.617 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.73 -34.59 45.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.46 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.05 -39.24 81.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.664 0.269 . . . . 0.0 110.931 -178.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 95.0 mmm -56.74 -47.8 79.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.908 0.385 . . . . 0.0 110.721 -179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.9 mt -56.09 -45.86 79.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.831 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.04 78.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.367 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.19 -52.86 57.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.971 0.415 . . . . 0.0 111.344 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -56.86 -46.14 81.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.014 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.99 -39.01 84.27 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.752 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -57.89 -45.2 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.48 -47.12 87.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.481 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.52 89.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.628 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.46 -42.2 91.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -58.85 -45.5 89.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.126 0.489 . . . . 0.0 110.098 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -126.22 104.85 8.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.117 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 97.1 mt -90.6 -11.86 38.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.75 15.05 15.45 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 2.9 t -107.41 94.88 12.37 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.251 -0.404 . . . . 0.0 110.376 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -48.8 -39.2 38.91 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.447 1.431 . . . . 0.0 113.37 -174.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -57.33 -49.57 75.71 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.78 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.13 98.5 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.39 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.453 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 46.3 mm-40 -59.06 -45.82 89.82 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.61 -47.31 73.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.422 -176.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.49 91.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.311 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -59.66 -44.29 93.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 110.931 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.5 m-85 -57.58 -46.41 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.352 0.596 . . . . 0.0 110.111 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -58.98 -45.22 91.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.709 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.9 mt -58.35 -44.92 88.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.575 -178.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -60.79 -41.65 96.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.926 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.568 HD12 HD22 ' A' ' 155' ' ' LEU . 15.2 mt -63.74 -46.13 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.621 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -58.6 -41.06 84.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.986 -177.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.3 m -84.42 15.67 3.54 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 61.98 50.76 3.97 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.481 0.658 . . . . 0.0 110.769 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.323 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -39.36 91.91 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 121.15 1.233 . . . . 0.0 111.687 -175.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.93 -37.98 69.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.959 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.13 -41.97 80.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.03 0.443 . . . . 0.0 110.129 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.6 t -55.22 -43.23 69.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.153 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.41 -52.17 54.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.61 67.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 0.0 111.172 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.1 ttt85 -72.19 -53.45 12.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.604 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -56.74 -31.56 64.67 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.756 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -76.84 -13.11 60.04 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 32.9 m -83.36 107.63 10.49 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.194 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.69 -15.8 22.33 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 121.215 1.277 . . . . 0.0 113.543 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.76 77.24 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.883 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 75.2 mt -99.88 141.59 16.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 117.615 0.707 . . . . 0.0 110.34 -176.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.453 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.15 156.13 26.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.753 -176.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.5 p -141.71 137.79 31.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.478 176.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 90.1 p -123.9 163.44 35.3 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.365 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -45.99 -46.0 16.66 Favored 'Trans proline' 0 N--CA 1.498 1.775 0 C-N-CA 121.424 1.416 . . . . 0.0 112.442 178.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -58.15 -43.06 87.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.363 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.3 m -60.08 -42.12 93.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.885 0.374 . . . . 0.0 110.601 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -58.02 -44.64 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.332 -178.238 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.85 -45.97 88.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.151 0.5 . . . . 0.0 110.252 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.568 HD22 HD12 ' A' ' 129' ' ' LEU . 36.4 mt -58.84 -41.46 86.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.585 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.537 ' CE2' HD11 ' A' ' 160' ' ' LEU . 45.5 t80 -58.62 -46.29 87.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.128 0.49 . . . . 0.0 110.351 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.0 ttp -57.6 -45.18 85.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.41 -45.64 87.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.45 92.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.461 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.541 HD22 ' OE1' ' A' ' 168' ' ' GLU . 95.6 mt -56.69 -43.33 80.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.581 -178.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.75 -46.53 88.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.278 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -56.62 -40.36 75.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.187 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 42.3 pt -88.4 14.0 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.05 14.67 82.38 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 121.415 -0.421 . . . . 0.0 113.592 173.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 61.7 mtt85 -97.15 86.02 3.85 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 117.831 0.816 . . . . 0.0 110.334 177.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -74.12 -39.74 63.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.394 -176.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 86.1 p -56.03 -51.04 69.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.909 0.385 . . . . 0.0 110.991 -176.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.541 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.2 mt-10 -59.88 -36.88 77.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.098 -178.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.37 -48.39 81.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.991 0.424 . . . . 0.0 110.355 -178.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -55.66 -43.71 76.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.936 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.91 -48.27 80.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.963 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.45 -45.98 85.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.493 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 -52.95 -48.87 67.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.407 -179.322 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -55.9 -39.6 71.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.973 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -64.39 -36.73 85.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.208 179.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.9 mt -77.94 123.97 27.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.866 0.365 . . . . 0.0 110.767 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -78.73 -38.84 37.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.91 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -54.75 -39.13 67.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.133 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -74.84 130.18 38.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.47 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -114.02 132.18 56.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.505 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -61.15 -41.24 96.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.61 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -120.22 141.03 50.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.493 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.562 -179.985 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 21.7 ttt . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -102.25 132.42 48.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.018 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.73 139.29 47.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.633 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.3 t -126.87 135.18 64.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.875 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 49.9 p -67.84 154.82 40.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.555 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -70.15 -35.33 73.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.544 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.96 -42.16 89.19 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.979 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.5 mtp -60.19 -48.09 83.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.446 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.0 mt -56.54 -44.87 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.796 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -49.08 78.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.407 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.3 m -54.01 -53.02 58.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 0.0 111.244 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.2 mmt-85 -56.73 -44.38 81.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.005 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -60.55 -40.35 91.25 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.693 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -58.3 -43.95 88.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 110.373 -178.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -60.76 -47.71 85.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.56 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.35 88.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.642 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.96 -42.0 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.861 -178.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.9 ttmp? -59.65 -46.93 87.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.063 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -124.93 109.98 13.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.451 178.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.8 -11.91 26.14 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 178.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.41 14.99 13.14 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.57 94.85 17.43 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.248 178.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -49.0 -34.69 29.98 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.341 1.361 . . . . 0.0 112.867 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -57.55 -55.38 35.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.84 0.352 . . . . 0.0 110.701 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.09 81.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.577 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.415 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.5 mm-40 -59.75 -46.37 89.37 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.684 -179.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.65 -46.77 74.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.918 0.389 . . . . 0.0 110.519 -176.155 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.22 -44.61 92.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.261 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -59.25 -44.71 92.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.978 0.418 . . . . 0.0 110.808 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.441 ' CB ' HD13 ' A' ' 155' ' ' LEU . 62.5 m-85 -57.66 -46.68 83.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.286 0.565 . . . . 0.0 110.141 -178.55 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 34.9 mttp -58.45 -46.73 85.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.54 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.18 -44.01 87.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.603 -177.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.2 -41.3 96.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.988 -177.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.468 HD11 ' O ' ' A' ' 155' ' ' LEU . 23.2 mt -64.29 -46.11 85.08 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.645 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -59.39 -40.15 85.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.094 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.8 m -84.17 15.0 3.75 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 -176.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 62.6 50.52 3.49 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.475 0.655 . . . . 0.0 110.76 177.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -124.93 49.6 3.4 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.177 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.521 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.3 Cg_endo -56.46 -40.53 83.98 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.17 1.247 . . . . 0.0 111.541 -175.32 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.13 -38.1 67.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.11 -179.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -68.28 -42.29 79.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.015 0.435 . . . . 0.0 110.021 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.61 -42.98 71.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.177 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 49.9 t -65.4 -51.92 58.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.572 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.5 t -54.73 -38.91 67.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.377 . . . . 0.0 111.258 -176.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -72.13 -53.07 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.539 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.69 -31.59 64.6 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -76.83 -14.52 59.9 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -81.83 107.81 9.42 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.789 -0.624 . . . . 0.0 110.232 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -57.98 -17.14 29.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 121.235 1.29 . . . . 0.0 113.51 -174.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.35 77.07 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.323 -0.465 . . . . 0.0 113.0 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.47 139.83 20.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 117.557 0.679 . . . . 0.0 110.389 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.415 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.31 156.05 16.51 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.633 0.73 . . . . 0.0 111.712 -176.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -144.21 137.83 27.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.457 176.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.3 p -126.0 163.49 39.27 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.42 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -46.04 -45.31 17.95 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.428 1.419 . . . . 0.0 112.477 178.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.23 -43.83 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.34 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.2 m -59.22 -41.61 89.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.498 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.02 -44.94 87.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.003 0.43 . . . . 0.0 110.445 -178.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.6 -45.42 89.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.164 0.507 . . . . 0.0 110.308 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.468 ' O ' HD11 ' A' ' 129' ' ' LEU . 41.7 mt -59.22 -42.21 90.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.477 -179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.548 ' CE2' HD11 ' A' ' 160' ' ' LEU . 50.0 t80 -58.05 -45.12 87.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.201 0.524 . . . . 0.0 110.327 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.99 -46.08 85.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.393 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.24 -45.21 88.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.508 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.54 92.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.075 0.464 . . . . 0.0 110.37 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.548 HD11 ' CE2' ' A' ' 156' ' ' TYR . 94.1 mt -56.17 -42.72 77.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.605 -178.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -59.83 -46.35 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.262 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -55.88 -41.57 74.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.156 -177.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.521 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.4 pt -88.77 14.06 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.35 20.57 79.92 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 121.38 -0.438 . . . . 0.0 113.31 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -97.12 85.92 3.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.637 0.719 . . . . 0.0 110.258 176.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -70.35 -45.04 66.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.311 -177.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.5 m -56.05 -51.02 69.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.807 0.337 . . . . 0.0 111.129 -176.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.48 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.0 mt-10 -59.29 -37.72 78.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.102 -178.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.84 -48.29 81.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.037 0.446 . . . . 0.0 110.403 -178.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.4 -44.11 75.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.951 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.87 -48.4 79.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.042 -179.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.5 t -57.52 -46.23 86.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.681 0.277 . . . . 0.0 110.408 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -52.94 -48.59 67.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.526 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -55.93 -39.08 71.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.051 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -62.99 -41.75 99.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.744 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.6 mt -64.78 -37.96 89.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.207 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -59.4 -36.84 76.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.261 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -91.27 136.22 33.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.866 0.365 . . . . 0.0 110.751 -179.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -127.4 145.08 50.94 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.344 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -127.22 142.04 51.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.496 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -57.94 -41.13 82.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -95.52 131.95 41.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.565 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.566 -179.96 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.1 m -60.18 132.38 25.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.66 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.4 143.36 42.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.589 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.3 t -105.65 134.11 48.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.91 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 78.3 p -94.08 150.07 20.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.613 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -63.95 -35.94 82.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.273 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.93 -36.18 74.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.224 -179.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.6 ttm -55.38 -44.63 76.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.913 0.387 . . . . 0.0 110.9 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.8 mt -55.8 -48.57 75.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.855 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -49.02 79.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -176.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.15 -53.24 53.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.009 0.433 . . . . 0.0 111.439 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -56.91 -44.52 82.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.978 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.53 -40.43 87.15 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.507 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -58.32 -45.09 88.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.873 0.368 . . . . 0.0 110.33 -178.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.36 -47.27 86.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.504 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.3 -44.59 92.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.69 -179.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -59.61 -43.2 93.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.863 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -59.3 -46.84 87.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.026 0.441 . . . . 0.0 110.029 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -124.06 108.76 12.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.386 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.43 -11.86 26.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.9 p -92.33 14.99 14.82 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 26.2 t -108.4 94.84 14.39 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 122.033 -0.417 . . . . 0.0 110.326 178.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -48.87 -34.89 29.77 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 121.345 1.363 . . . . 0.0 113.028 -175.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.94 -55.05 39.93 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.653 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.91 84.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.561 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.403 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.7 mm-40 -59.8 -45.52 92.08 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.678 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.57 75.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.969 0.414 . . . . 0.0 110.432 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.38 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.322 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.99 -44.9 91.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.788 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -57.8 -47.46 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -57.97 -46.27 85.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.0 mt -58.58 -44.32 89.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.562 -177.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.4 HD22 ' HB2' ' A' ' 136' ' ' TYR . 19.0 mt -60.34 -40.82 92.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.876 -177.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.86 -46.03 83.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.796 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.85 -39.74 82.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.974 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.3 m -85.33 15.15 4.56 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 62.48 50.43 3.65 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 121.459 0.647 . . . . 0.0 110.848 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.395 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.553 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.8 Cg_endo -56.14 -39.18 92.87 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.305 1.337 . . . . 0.0 111.523 -176.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.63 -38.26 69.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.06 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.4 ' HB2' HD22 ' A' ' 128' ' ' LEU . 17.3 m-85 -67.97 -42.83 80.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.019 0.438 . . . . 0.0 110.024 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.37 -42.09 65.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 55.7 t -65.84 -53.1 41.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.536 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 25.4 m -54.46 -38.04 65.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 111.24 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -72.98 -54.03 9.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.604 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -57.3 -30.3 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.784 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -76.96 -13.99 59.9 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.9 m -84.85 107.12 10.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.78 -0.628 . . . . 0.0 110.325 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -58.39 -15.18 23.28 Favored 'Trans proline' 0 N--CA 1.502 1.973 0 C-N-CA 121.219 1.28 . . . . 0.0 113.612 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.03 77.25 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.896 -177.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.4 mt -98.65 140.18 18.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 117.49 0.645 . . . . 0.0 110.355 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.403 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.64 156.14 20.72 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.544 0.688 . . . . 0.0 111.701 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.0 p -147.15 137.93 23.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.33 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -123.77 165.07 25.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.422 178.062 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.87 -43.96 18.92 Favored 'Trans proline' 0 N--CA 1.498 1.768 0 C-N-CA 121.434 1.423 . . . . 0.0 112.516 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.81 -45.94 88.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.257 177.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 72.1 m -58.0 -40.91 81.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.959 0.409 . . . . 0.0 110.513 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.52 -45.96 87.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.986 0.422 . . . . 0.0 110.456 -177.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -58.57 -44.37 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.255 0.55 . . . . 0.0 110.171 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.86 -42.15 83.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.54 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.421 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 20.9 t80 -58.97 -46.95 86.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.344 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.27 -43.2 82.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.448 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -59.32 -49.64 77.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.317 -178.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.21 -40.93 82.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.443 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.471 HD22 ' OE1' ' A' ' 168' ' ' GLU . 92.4 mt -56.93 -43.8 81.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.916 0.389 . . . . 0.0 110.444 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.64 -44.6 93.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.198 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 53.7 mtt-85 -55.58 -42.87 75.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.196 -176.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.553 HG23 ' HB2' ' A' ' 134' ' ' PRO . 26.1 pt -90.1 14.08 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.82 26.25 69.74 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 121.272 -0.49 . . . . 0.0 112.985 174.071 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -97.06 86.03 3.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 117.315 0.557 . . . . 0.0 109.952 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.62 -50.86 61.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.317 -176.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.0 t -55.91 -51.13 68.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.807 0.337 . . . . 0.0 111.281 -175.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.471 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.7 mt-10 -59.58 -40.97 89.12 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.033 -176.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.94 -47.27 85.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.86 0.362 . . . . 0.0 110.653 -177.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -55.62 -45.63 77.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.977 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.83 -49.8 75.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.35 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.8 t -56.98 -49.7 78.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.699 -178.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 77.0 ttt-85 -54.53 -50.02 68.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.285 -177.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.0 -40.19 76.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.777 0.322 . . . . 0.0 110.854 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -60.05 -41.75 92.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.59 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.3 mt -65.94 -39.6 90.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.917 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -61.24 -46.55 89.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.74 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -150.0 162.03 41.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.637 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -110.52 129.1 55.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.429 179.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -119.12 140.59 49.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.555 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -149.82 -66.17 0.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.515 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -56.81 -40.59 76.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.773 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.535 -179.967 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 94.2 mmm . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.44 HG23 ' N ' ' A' ' 98' ' ' ALA . 35.0 m -60.22 -39.92 82.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.827 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.44 ' N ' HG23 ' A' ' 97' ' ' VAL . . . -76.4 142.86 40.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.669 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.3 t -107.87 132.81 54.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.932 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.9 t -94.03 144.06 25.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.614 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -55.28 -36.68 66.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.214 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.94 -39.61 82.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.781 0.324 . . . . 0.0 110.799 -179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 66.4 mtt -56.28 -42.59 77.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.83 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 127' ' ' LEU . 26.7 mt -53.88 -52.19 61.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.036 0.446 . . . . 0.0 111.077 -178.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.33 -48.98 75.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.58 -175.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.2 m -53.08 -54.05 41.32 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.703 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.543 ' HD2' HD11 ' A' ' 127' ' ' LEU . 81.5 mtt-85 -63.57 -37.74 88.45 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.846 -177.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -60.51 -39.93 89.59 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.485 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -59.06 -46.5 88.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.871 0.367 . . . . 0.0 110.182 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.08 -45.7 92.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.519 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.76 -46.01 90.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.676 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -58.93 -43.1 91.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.898 -177.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.63 -47.2 87.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.941 0.4 . . . . 0.0 110.115 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -120.02 105.58 11.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.316 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -92.29 -12.01 33.64 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.96 15.04 14.02 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.7 t -107.75 94.66 12.69 Favored Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 118.046 0.385 . . . . 0.0 110.296 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.89 -39.68 39.72 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.44 1.427 . . . . 0.0 113.162 -175.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -56.52 -51.31 69.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.826 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.57 -42.78 93.25 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.511 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -59.1 -45.39 90.99 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.783 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.72 -47.11 74.16 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.934 0.397 . . . . 0.0 110.527 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.1 92.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.278 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -59.83 -44.85 93.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.493 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.3 m-85 -57.4 -46.41 83.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 110.086 -178.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -58.78 -45.86 88.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.748 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.543 HD11 ' HD2' ' A' ' 107' ' ' ARG . 16.6 mt -58.2 -44.82 88.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 -178.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.6 mt -60.61 -40.68 92.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.932 -176.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.465 HD12 HD22 ' A' ' 155' ' ' LEU . 16.1 mt -64.66 -46.22 83.43 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.684 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.45 -39.48 83.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.071 -177.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.8 m -86.01 16.62 4.06 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 62.36 50.57 3.71 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.495 0.665 . . . . 0.0 110.857 176.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.9 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.21 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.492 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.7 Cg_endo -57.23 -40.86 79.34 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.233 1.289 . . . . 0.0 111.629 -174.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.55 -37.79 68.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.037 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.22 -42.78 79.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.078 -178.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.43 -42.89 69.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.122 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.8 t -65.52 -52.19 54.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.572 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 m -54.91 -38.85 68.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.238 -176.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.04 -53.28 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.52 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.74 -32.6 65.72 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.011 -0.276 . . . . 0.0 111.661 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.83 -12.36 59.96 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.399 0.889 . . . . 0.0 113.399 -177.017 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.0 m -83.72 107.63 10.9 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.146 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -57.66 -16.67 25.56 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.185 1.256 . . . . 0.0 113.489 -174.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.25 76.97 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.962 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -100.21 140.96 18.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.597 0.698 . . . . 0.0 110.342 -176.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.66 156.11 20.83 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.629 0.728 . . . . 0.0 111.741 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.52 137.91 30.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.426 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 93.7 p -124.55 163.31 37.43 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.384 177.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -45.96 -45.01 18.12 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.483 1.455 . . . . 0.0 112.458 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.33 -43.24 88.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.378 177.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' CYS . . . . . 0.401 ' HA ' HD12 ' A' ' 155' ' ' LEU . 75.8 m -59.75 -41.62 91.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.989 0.423 . . . . 0.0 110.572 -179.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.12 -45.77 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.039 0.447 . . . . 0.0 110.432 -178.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.97 -45.54 90.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.203 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.493 HD13 ' CB ' ' A' ' 125' ' ' TYR . 44.8 mt -58.22 -41.38 83.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.555 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.9 t80 -59.36 -47.37 85.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.203 0.525 . . . . 0.0 110.467 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.72 -44.5 86.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.49 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.41 -45.97 90.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.09 -44.09 91.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.947 0.404 . . . . 0.0 110.32 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.555 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.4 mt -56.4 -43.29 79.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.681 -178.389 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.68 -46.36 89.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 8.7 mtp-105 -56.88 -40.92 77.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.271 -177.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.492 HG23 ' HB2' ' A' ' 134' ' ' PRO . 39.0 pt -87.57 14.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -175.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.61 20.25 79.79 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 119.859 -0.412 . . . . 0.0 113.331 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -97.14 85.98 3.84 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 117.734 0.767 . . . . 0.0 110.011 176.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -66.09 -47.21 75.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.496 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 84.3 p -55.97 -51.06 69.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.78 0.324 . . . . 0.0 111.272 -175.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.492 ' OE1' HD22 ' A' ' 160' ' ' LEU . 88.9 mt-10 -60.85 -39.43 89.09 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.911 -0.316 . . . . 0.0 111.084 -176.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.25 -47.52 84.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.828 0.347 . . . . 0.0 110.621 -177.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -55.76 -44.98 78.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.959 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.08 77.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.217 -178.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 49.3 t -57.68 -49.4 80.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.685 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -54.14 -47.78 71.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.428 -177.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -55.99 -38.64 70.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.039 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -62.6 -39.43 93.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.868 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.5 mt -64.59 -43.97 92.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.911 -178.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -140.05 143.9 36.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.826 0.346 . . . . 0.0 110.77 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -120.21 143.77 48.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.492 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -119.61 145.86 46.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.428 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -98.94 107.29 19.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.547 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -60.54 -41.1 93.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.661 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 79.3 m80 -132.21 159.0 40.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.502 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.575 -179.981 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.1 mtm . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -108.07 133.0 54.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.019 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -84.0 140.07 32.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.582 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.2 t -104.54 134.17 46.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.95 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.1 m -94.03 146.31 24.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.655 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -61.33 -37.37 83.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.177 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.97 88.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.801 0.334 . . . . 0.0 110.764 -178.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.3 ttm -56.71 -47.54 79.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.931 0.396 . . . . 0.0 110.719 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.81 -46.39 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.93 79.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.392 -176.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.4 -52.83 58.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.019 0.438 . . . . 0.0 111.397 -178.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -56.71 -45.66 81.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.059 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -60.25 -39.38 86.57 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.705 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.4 ' HG2' ' HZ2' ' A' ' 113' ' ' LYS . 38.7 tt0 -57.74 -44.36 85.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.337 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -61.04 -48.66 80.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.496 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.57 -42.81 88.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.686 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -59.11 -43.39 91.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 -178.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.4 ' HZ2' ' HG2' ' A' ' 109' ' ' GLN . 37.4 mttp -58.91 -46.94 86.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.117 0.484 . . . . 0.0 110.076 179.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -125.93 108.8 11.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.473 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.39 -11.96 26.81 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 177.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.61 14.73 14.23 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.1 t -107.87 94.82 13.23 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.066 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -48.78 -34.77 28.81 Favored 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.396 1.397 . . . . 0.0 113.114 -174.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.76 -55.41 35.18 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.652 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.67 85.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.555 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -59.28 -45.56 90.92 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.772 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.74 -49.19 71.42 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.461 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.75 89.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.37 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' PHE . . . . . 0.421 ' HA ' HD12 ' A' ' 127' ' ' LEU . 17.1 t80 -59.28 -44.36 92.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.483 ' CB ' HD13 ' A' ' 155' ' ' LEU . 58.4 m-85 -56.76 -43.98 81.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.349 0.595 . . . . 0.0 110.178 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -58.19 -48.21 81.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.938 -178.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 124' ' ' PHE . 44.3 mt -57.0 -43.88 82.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.612 -176.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.413 HD22 ' HB2' ' A' ' 136' ' ' TYR . 22.3 mt -61.22 -41.02 96.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.956 -177.016 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.454 HD12 HD22 ' A' ' 155' ' ' LEU . 14.0 mt -64.53 -46.05 84.56 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.511 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.72 -40.49 83.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.9 m -85.44 15.98 4.09 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 m120 61.8 51.18 3.94 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.506 0.669 . . . . 0.0 110.718 177.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -124.87 49.88 3.59 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.149 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.44 -39.81 88.8 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.108 1.205 . . . . 0.0 111.58 -175.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.92 -38.15 69.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.994 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' TYR . . . . . 0.413 ' HB2' HD22 ' A' ' 128' ' ' LEU . 4.1 m-85 -68.18 -42.54 79.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.04 0.448 . . . . 0.0 110.086 -178.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.75 -42.86 71.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.151 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.71 -52.12 54.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.647 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -55.06 -38.69 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.82 0.343 . . . . 0.0 111.115 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.03 -53.01 14.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.495 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.61 -32.51 65.34 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.726 -176.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -76.98 -12.18 59.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -177.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.7 m -84.01 107.87 12.06 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.226 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -57.62 -16.3 23.84 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 121.263 1.309 . . . . 0.0 113.542 -174.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -22.66 77.19 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 121.228 -0.51 . . . . 0.0 112.902 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.5 mt -100.89 140.32 20.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.574 0.687 . . . . 0.0 110.281 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.21 156.16 22.68 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.69 0.757 . . . . 0.0 111.578 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.5 p -143.03 137.81 29.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.411 175.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -126.1 165.09 29.55 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.463 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.88 -44.12 18.8 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 121.486 1.457 . . . . 0.0 112.424 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.6 -45.35 89.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.903 0.382 . . . . 0.0 110.288 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.4 m -58.78 -41.01 85.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.56 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.18 -45.47 87.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.435 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -59.1 -46.36 88.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.483 HD13 ' CB ' ' A' ' 125' ' ' TYR . 46.5 mt -58.1 -42.25 85.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.519 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.543 ' CE2' HD11 ' A' ' 160' ' ' LEU . 46.8 t80 -59.91 -45.99 90.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.659 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.4 ttp -57.72 -45.44 85.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.411 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -58.73 -46.0 88.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.41 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.19 90.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.09 0.472 . . . . 0.0 110.364 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.543 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.9 mt -56.58 -44.19 80.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.655 -178.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -58.95 -46.11 88.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.4 mtp180 -56.62 -41.02 76.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.226 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -89.23 14.05 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -175.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.63 19.78 79.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 121.342 -0.456 . . . . 0.0 113.399 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 -97.17 91.87 5.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 117.598 0.699 . . . . 0.0 110.192 176.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -75.43 -40.26 57.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.366 -176.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.0 m -55.96 -51.07 69.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.752 0.311 . . . . 0.0 111.168 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.511 ' CB ' HD13 ' A' ' 160' ' ' LEU . 43.8 mt-10 -60.45 -38.83 85.39 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.966 -177.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.7 -47.5 85.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.879 0.371 . . . . 0.0 110.495 -177.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -55.88 -44.83 78.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.837 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.72 -48.74 78.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.269 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.0 t -57.72 -47.27 86.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.544 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -53.07 -49.71 65.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.652 0.263 . . . . 0.0 111.555 -178.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -56.01 -39.29 71.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.956 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -63.93 -40.25 96.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.862 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 80.2 mt -66.28 -37.99 86.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.148 -178.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -64.35 -46.22 84.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.943 -178.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -146.82 164.61 32.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.825 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -127.82 172.08 11.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.397 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -100.33 129.51 46.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.607 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -58.05 -42.4 85.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.6 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -138.75 143.66 39.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.563 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 . . . . . 0 C--O 1.219 -0.502 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.536 179.904 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 94.3 mmm . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.5 m -132.54 153.04 37.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.526 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.77 141.26 44.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.637 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -108.02 134.97 48.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.933 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 p -94.03 151.2 19.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.697 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -72.01 -27.09 62.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.198 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.93 -39.14 80.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.627 0.251 . . . . 0.0 110.906 -177.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.6 mtp -56.25 -47.76 77.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.953 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.1 mt -56.04 -47.34 78.06 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.956 -178.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.18 78.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.386 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.88 -52.43 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 111.243 -178.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -56.76 -45.7 81.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.62 -40.06 86.31 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.556 -178.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.33 -45.66 87.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.882 0.372 . . . . 0.0 110.401 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -60.25 -46.18 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.453 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.67 84.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.659 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.48 -40.51 87.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.939 -177.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.36 -46.8 87.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.052 0.453 . . . . 0.0 109.976 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -125.48 108.08 11.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.3 177.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.9 mt -93.39 -11.81 31.36 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.43 14.96 15.1 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -108.36 94.82 14.26 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 118.057 0.39 . . . . 0.0 110.291 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -48.83 -34.45 28.18 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 121.417 1.411 . . . . 0.0 113.105 -175.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -58.32 -55.2 38.06 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.629 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.78 -41.67 82.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.641 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.402 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.4 mm-40 -59.8 -46.38 89.4 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.419 -0.512 . . . . 0.0 109.658 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.66 -45.52 73.87 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.98 0.419 . . . . 0.0 110.531 -175.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.49 92.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.204 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -58.99 -44.26 91.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.001 0.429 . . . . 0.0 110.8 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.499 ' CB ' HD13 ' A' ' 155' ' ' LEU . 60.7 m-85 -57.47 -46.79 83.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 0.0 110.063 -178.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -58.19 -46.65 85.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.521 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.28 -43.76 88.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 -177.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.3 mt -61.45 -41.05 96.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.983 -176.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.454 HD11 ' O ' ' A' ' 155' ' ' LEU . 19.6 mt -64.92 -46.03 83.35 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.716 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.4 -39.76 84.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.133 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.5 m -85.27 16.32 3.72 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -176.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 62.16 50.66 3.85 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.488 0.661 . . . . 0.0 110.731 176.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -124.89 49.57 3.35 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.375 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.486 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.2 Cg_endo -57.04 -40.43 83.87 Favored 'Trans proline' 0 N--CA 1.497 1.687 0 C-N-CA 121.168 1.245 . . . . 0.0 111.691 -175.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.66 -37.41 68.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.024 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.81 -42.1 77.74 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.974 0.416 . . . . 0.0 110.135 -178.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.13 -41.82 61.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.269 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 62.0 t -65.26 -53.23 42.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.514 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 m -54.45 -38.42 66.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 111.238 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.2 ttt85 -73.08 -53.27 11.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.535 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -57.37 -30.33 64.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.733 -176.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.79 -12.79 60.03 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.4 m -85.66 106.98 10.81 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.69 -0.671 . . . . 0.0 110.241 179.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.43 -14.17 19.58 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.209 1.273 . . . . 0.0 113.613 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.76 76.83 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.772 -177.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -98.37 140.73 17.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 117.53 0.665 . . . . 0.0 110.377 -176.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.402 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -62.08 156.06 22.47 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.619 0.723 . . . . 0.0 111.719 -177.108 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -144.88 137.86 26.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.505 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.06 165.06 29.66 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.386 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.93 -44.63 18.43 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.476 1.451 . . . . 0.0 112.476 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.34 -44.8 88.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.948 0.404 . . . . 0.0 110.3 177.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' CYS . . . . . 0.421 ' HA ' HD12 ' A' ' 155' ' ' LEU . 74.9 m -58.79 -42.15 88.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.476 -179.357 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' MET . . . . . 0.462 ' CB ' HD21 ' A' ' 176' ' ' LEU . 23.1 mtp -58.82 -45.09 90.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.546 -177.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -58.56 -45.48 88.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.206 0.526 . . . . 0.0 110.19 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.499 HD13 ' CB ' ' A' ' 125' ' ' TYR . 35.1 mt -58.16 -43.19 87.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.284 0.564 . . . . 0.0 110.288 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.405 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.4 t80 -57.9 -45.31 86.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.362 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -57.72 -45.16 86.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.456 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.63 -46.12 87.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.463 -178.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.64 91.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.486 HD22 ' OE1' ' A' ' 168' ' ' GLU . 93.3 mt -56.36 -43.58 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.581 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -59.71 -46.1 90.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.239 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -56.34 -40.89 75.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.222 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.486 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.8 pt -88.28 13.99 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -174.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.58 19.79 78.93 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.382 -0.437 . . . . 0.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.405 ' HD2' HD11 ' A' ' 163' ' ' ILE . 94.3 mtt180 -97.08 85.97 3.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.645 0.723 . . . . 0.0 110.124 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -69.99 -46.95 64.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.396 -176.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.1 m -55.96 -51.06 69.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.769 0.319 . . . . 0.0 111.173 -175.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.486 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.6 mt-10 -58.93 -40.5 84.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.933 -177.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.24 -47.51 84.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.873 0.368 . . . . 0.0 110.747 -177.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -55.46 -45.55 76.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.001 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.93 -49.89 75.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.26 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 53.8 t -57.02 -49.35 79.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 C-N-CA 120.961 -0.295 . . . . 0.0 110.641 -178.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -54.32 -50.04 68.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.31 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -57.36 -40.43 78.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.791 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -61.42 -37.47 83.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.192 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.462 HD21 ' CB ' ' A' ' 153' ' ' MET . 25.1 mt -73.84 144.34 45.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.868 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -121.48 145.86 47.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.363 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -56.9 110.57 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.732 -179.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -144.03 154.6 43.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.61 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -105.97 117.66 34.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.478 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 -81.47 -41.71 21.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.623 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -102.95 139.04 39.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.577 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.597 179.783 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 54.5 ttp . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.7 p -135.2 141.87 41.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.384 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.33 142.23 54.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.58 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.5 m -132.73 151.01 33.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.407 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.9 t -82.06 125.3 30.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.653 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -61.06 -32.29 71.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.746 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.89 77.64 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.133 -177.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.8 mtp -55.71 -50.53 70.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.948 0.404 . . . . 0.0 111.045 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.5 mt -55.57 -47.16 76.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.009 -178.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.69 -49.06 79.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.529 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.6 m -54.08 -52.69 60.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.871 0.367 . . . . 0.0 111.265 -178.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 33.6 mmt180 -57.28 -45.16 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.885 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -59.87 -40.2 87.82 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.548 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -58.61 -45.58 88.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.817 0.341 . . . . 0.0 110.308 -178.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.35 -46.18 90.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.536 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.62 -48.05 83.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.5 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.27 -40.77 87.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.95 -177.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.4 tttp -59.29 -46.28 88.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.081 0.467 . . . . 0.0 110.008 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -126.11 108.66 11.55 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.317 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -93.47 -11.94 30.87 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.31 15.01 14.73 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 17.7 t -108.51 94.72 14.39 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.255 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -48.73 -34.95 28.97 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 121.379 1.386 . . . . 0.0 113.067 -175.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.77 -55.06 39.74 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.634 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.65 83.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.638 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -59.47 -45.9 90.32 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.74 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.46 -47.2 73.19 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.127 0.489 . . . . 0.0 110.424 -176.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -45.07 92.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.265 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -58.64 -44.27 90.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.808 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.474 ' CB ' HD13 ' A' ' 155' ' ' LEU . 61.7 m-85 -57.58 -46.75 83.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.272 0.558 . . . . 0.0 110.103 -178.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 29.9 mttp -58.51 -45.93 87.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.683 -178.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.47 -44.37 89.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.529 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.87 -41.28 95.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.994 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.492 HD11 ' O ' ' A' ' 155' ' ' LEU . 23.2 mt -64.68 -46.14 83.67 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.714 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.94 -40.02 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.071 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 68.1 m -85.75 16.57 3.91 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 61.76 51.06 4.02 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.42 0.628 . . . . 0.0 110.697 176.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -124.86 49.6 3.36 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.272 177.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.548 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.8 Cg_endo -56.19 -40.65 83.47 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.225 1.283 . . . . 0.0 111.579 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.46 -38.03 68.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.09 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.63 -41.78 78.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 110.188 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.3 t -55.44 -42.39 67.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.235 179.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 52.6 t -65.96 -52.49 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.7 m -54.63 -38.33 66.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.801 0.334 . . . . 0.0 111.212 -176.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -73.06 -53.35 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.516 -178.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -56.78 -31.58 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.91 -12.91 60.02 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.5 m -84.69 107.45 11.38 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-O 118.73 -0.653 . . . . 0.0 110.24 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.83 -15.83 23.19 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 121.238 1.292 . . . . 0.0 113.554 -174.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.08 -22.16 77.18 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.868 -177.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -100.24 139.44 21.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 117.646 0.723 . . . . 0.0 110.266 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.09 156.07 18.94 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.571 0.701 . . . . 0.0 111.861 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.7 p -144.77 137.89 26.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.394 176.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -126.03 164.99 30.02 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.547 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.86 -44.84 17.94 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.506 1.471 . . . . 0.0 112.533 179.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.29 -44.03 88.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.981 0.419 . . . . 0.0 110.376 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.7 m -59.17 -41.76 89.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.489 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.33 -45.67 87.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.412 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.49 ' HG2' HD13 ' A' ' 176' ' ' LEU . 93.5 mt-10 -58.53 -45.4 88.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.127 0.489 . . . . 0.0 110.238 -179.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.492 ' O ' HD11 ' A' ' 129' ' ' LEU . 45.0 mt -58.41 -42.67 87.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.347 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -58.12 -45.69 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.124 0.488 . . . . 0.0 110.354 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.06 -44.35 82.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.497 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -58.99 -49.06 79.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.229 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.56 83.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.566 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.81 -43.23 80.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.958 0.408 . . . . 0.0 110.403 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.89 -44.71 94.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.281 177.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -55.48 -43.09 75.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.068 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.548 HG23 ' HB2' ' A' ' 134' ' ' PRO . 31.4 pt -89.24 14.14 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -174.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.93 25.59 68.92 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 121.238 -0.506 . . . . 0.0 113.116 173.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.45 ' NE ' HD12 ' A' ' 163' ' ' ILE . 88.3 mtt180 -97.06 86.08 3.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 117.353 0.577 . . . . 0.0 110.05 175.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -67.17 -52.0 46.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.377 -176.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.4 m -55.92 -51.08 68.9 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.258 -175.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.83 -41.26 90.93 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.957 -177.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.42 -46.73 87.22 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.699 -176.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -56.01 -45.89 78.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.849 0.357 . . . . 0.0 110.937 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.87 -49.68 75.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.323 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 46.2 t -60.58 -47.51 92.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.71 0.291 . . . . 0.0 110.748 -178.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -53.74 -47.1 70.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.405 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -55.91 -39.21 71.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.037 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -60.19 -41.34 92.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 110.719 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 176' ' ' LEU . . . . . 0.49 HD13 ' HG2' ' A' ' 154' ' ' GLU . 79.3 mt -69.68 -35.37 75.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.506 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -54.37 -37.54 65.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.3 -178.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -62.01 134.04 56.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.78 0.324 . . . . 0.0 110.507 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -69.04 160.37 31.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.526 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -90.36 123.73 34.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.474 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -56.67 -40.53 75.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.823 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -84.39 136.1 34.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.652 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 45.6 m80 . . . . . 0 C--O 1.219 -0.538 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.511 179.937 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -108.05 127.82 63.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.022 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.93 146.54 27.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.53 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.9 t -101.31 126.5 55.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.961 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 53.4 p -93.99 159.23 15.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.624 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -57.53 -36.24 71.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.23 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.01 -40.72 85.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.75 0.31 . . . . 0.0 110.766 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.6 mtp -56.95 -45.81 82.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.873 0.368 . . . . 0.0 110.648 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.53 -46.48 80.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.3 -49.02 79.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.296 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.67 -53.33 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.357 -178.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -56.72 -43.75 80.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.26 -40.44 90.33 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.61 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -57.99 -43.76 86.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.898 0.38 . . . . 0.0 110.398 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -60.59 -47.81 84.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.482 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.85 90.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.671 -178.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.26 -42.32 90.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.863 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.0 tttp -58.95 -46.02 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.06 0.457 . . . . 0.0 110.036 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -127.68 110.39 12.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.381 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.8 mt -95.3 -11.91 27.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.08 15.01 14.3 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.9 t -108.67 94.87 15.02 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 119.195 -0.431 . . . . 0.0 110.295 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.77 -34.4 27.65 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.402 1.401 . . . . 0.0 113.038 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.79 -55.67 31.89 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.683 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.7 83.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.579 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.408 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 41.9 mm-40 -59.68 -45.8 90.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.739 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.64 75.08 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.963 0.411 . . . . 0.0 110.481 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.39 -44.55 92.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.285 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.04 -44.87 91.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.025 0.44 . . . . 0.0 110.926 -178.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.48 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.6 m-85 -57.7 -46.66 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.341 0.591 . . . . 0.0 110.099 -178.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.7 mttp -58.48 -45.96 87.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.4 mt -58.21 -44.38 88.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 -178.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 20.0 mt -60.86 -40.88 94.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.924 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.466 HD12 HD22 ' A' ' 155' ' ' LEU . 15.2 mt -64.42 -46.1 84.69 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.67 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -58.92 -39.93 83.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.746 0.308 . . . . 0.0 111.08 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.7 m -85.05 14.91 4.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -176.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.8 t30 62.53 50.56 3.55 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.499 0.666 . . . . 0.0 110.808 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.204 177.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.514 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.9 Cg_endo -56.96 -39.12 93.77 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 121.159 1.239 . . . . 0.0 111.605 -175.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -55.88 -38.07 69.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.05 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -68.41 -42.18 79.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.938 0.399 . . . . 0.0 110.059 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.5 t -55.77 -42.89 71.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.187 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.9 t -65.83 -51.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.617 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.1 t -54.84 -38.7 67.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.931 0.396 . . . . 0.0 111.183 -176.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -72.42 -53.12 13.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.551 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -56.55 -32.15 64.85 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.683 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.88 -11.91 59.89 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -85.28 107.22 11.24 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.292 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.98 -15.22 21.47 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 121.298 1.332 . . . . 0.0 113.502 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.88 77.28 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 121.279 -0.486 . . . . 0.0 112.858 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.3 mt -99.83 141.14 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.514 0.657 . . . . 0.0 110.282 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.408 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.58 156.07 20.65 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.624 0.726 . . . . 0.0 111.689 -176.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -142.8 137.91 30.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.454 176.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 96.7 p -125.97 163.34 40.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.406 177.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.13 -45.22 18.43 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 121.459 1.439 . . . . 0.0 112.454 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.44 -43.48 88.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.251 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.1 m -59.69 -41.36 90.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.562 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.1 -45.16 87.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.999 0.428 . . . . 0.0 110.429 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.81 -45.27 90.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.224 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.48 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.7 mt -58.97 -41.77 88.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.562 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.534 ' CE2' HD11 ' A' ' 160' ' ' LEU . 49.4 t80 -58.8 -45.99 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.184 0.516 . . . . 0.0 110.347 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.497 ' HB2' HG11 ' A' ' 172' ' ' VAL . 64.1 ttp -57.68 -46.01 84.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.39 -179.204 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.41 -45.23 88.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.503 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.4 -44.49 92.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.436 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.534 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.4 mt -56.09 -42.31 76.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.694 -178.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -60.24 -46.17 90.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.231 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.3 mtp85 -56.43 -41.39 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.216 -177.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.514 HG23 ' HB2' ' A' ' 134' ' ' PRO . 37.2 pt -88.18 14.02 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -175.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.36 24.67 74.95 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 121.498 -0.382 . . . . 0.0 113.06 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 45.1 mtp85 -97.12 86.99 4.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 117.485 0.642 . . . . 0.0 110.056 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -65.89 -45.59 81.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.641 -175.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 21.8 m -55.93 -51.14 68.69 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.339 -174.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.448 ' OE1' HD22 ' A' ' 160' ' ' LEU . 88.4 mt-10 -62.8 -38.27 90.03 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.101 -176.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.96 -46.96 87.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.876 0.37 . . . . 0.0 110.445 -178.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -55.87 -45.05 78.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.918 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.85 -48.0 81.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.029 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.497 HG11 ' HB2' ' A' ' 157' ' ' MET . 48.8 t -58.31 -45.18 89.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.522 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -53.01 -49.2 66.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.674 0.273 . . . . 0.0 111.498 -179.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -55.84 -39.92 72.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.957 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -65.33 -36.67 84.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.178 178.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 41.5 mt -96.92 108.81 21.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 0.0 110.72 -177.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -146.18 -71.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.287 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -150.08 -65.56 0.21 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.878 0.37 . . . . 0.0 110.297 178.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -138.42 168.95 18.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.212 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -56.83 146.42 26.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.795 0.331 . . . . 0.0 110.697 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -56.85 -40.81 76.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.741 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -86.61 131.01 34.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.587 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.976 -1.012 . . . . 0.0 110.535 -179.832 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 97.5 mmm . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 27.4 m -79.29 -37.29 18.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.139 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.76 129.95 34.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 110.801 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.2 t -134.4 137.78 50.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.908 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 44.9 t -79.31 136.63 37.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.0 p-80 -67.56 -35.46 79.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.391 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.23 87.1 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.746 0.307 . . . . 0.0 110.692 -178.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.5 mtp -56.46 -44.47 80.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.773 0.32 . . . . 0.0 110.758 -179.284 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 127' ' ' LEU . 13.7 mt -53.53 -52.11 60.72 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.116 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.46 -49.01 73.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.716 -174.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -54.17 -54.08 44.7 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.583 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.599 ' HD2' HD11 ' A' ' 127' ' ' LEU . 77.8 mtt-85 -63.93 -37.05 85.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.942 -177.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -61.26 -40.14 92.97 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.468 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -59.31 -45.58 90.92 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.19 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -59.95 -45.2 93.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.542 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.32 -47.7 84.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.62 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -58.96 -41.55 87.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.969 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -59.76 -47.16 86.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.073 0.464 . . . . 0.0 110.024 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -125.74 111.12 14.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.366 177.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.7 mt -94.64 -11.99 28.24 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -91.71 15.06 13.52 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.3 t -107.81 94.89 13.23 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.295 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -48.92 -37.22 36.28 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.363 1.375 . . . . 0.0 113.113 -174.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.27 -53.79 54.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 0.0 110.675 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.19 -42.68 86.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.598 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.46 -45.15 92.44 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.77 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -47.08 73.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.937 0.398 . . . . 0.0 110.477 -176.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.02 -44.54 91.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.338 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.71 -43.66 94.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.433 . . . . 0.0 110.863 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.473 ' CB ' HD13 ' A' ' 155' ' ' LEU . 62.6 m-85 -57.64 -46.49 84.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.321 0.581 . . . . 0.0 110.018 -179.125 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.9 mttt -58.89 -42.95 90.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.758 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.599 HD11 ' HD2' ' A' ' 107' ' ' ARG . 14.1 mt -58.26 -48.15 81.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.0 110.35 -179.317 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.39 -40.19 85.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.592 HD12 HD22 ' A' ' 155' ' ' LEU . 23.9 mt -65.37 -46.13 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.832 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -59.02 -39.14 81.0 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.969 -177.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.1 m -87.61 17.34 4.71 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.2 t30 62.15 50.56 3.91 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.431 0.634 . . . . 0.0 110.883 176.194 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.86 49.45 3.23 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.544 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.34 -39.69 89.65 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 121.236 1.291 . . . . 0.0 111.707 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.36 -38.46 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.016 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -67.98 -41.97 81.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.412 . . . . 0.0 110.126 -178.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.95 -43.53 75.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.185 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.2 t -65.1 -51.99 58.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.539 -177.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -55.29 -39.41 69.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.945 0.403 . . . . 0.0 111.135 -176.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -71.66 -51.7 21.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.573 -178.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -57.14 -33.06 67.0 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.649 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -76.96 -10.2 59.21 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.6 m -84.2 107.54 11.17 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.708 -0.663 . . . . 0.0 110.223 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.74 -17.39 29.12 Favored 'Trans proline' 0 N--CA 1.501 1.956 0 C-N-CA 121.237 1.291 . . . . 0.0 113.478 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.91 -21.65 76.8 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.01 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.2 mt -101.08 140.3 20.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 117.58 0.69 . . . . 0.0 110.355 -176.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.61 156.11 24.19 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.767 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -142.8 137.85 29.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.381 176.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.5 p -125.96 165.11 29.17 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.457 177.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.96 -44.58 18.63 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 121.416 1.411 . . . . 0.0 112.482 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.51 -44.36 89.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.273 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.43 -41.91 90.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.401 . . . . 0.0 110.523 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.15 -45.35 87.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.358 -177.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -58.8 -45.9 88.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.206 0.527 . . . . 0.0 110.235 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.592 HD22 HD12 ' A' ' 129' ' ' LEU . 34.5 mt -59.09 -41.33 87.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.556 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.569 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.2 t80 -58.16 -46.56 85.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.178 0.513 . . . . 0.0 110.149 179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.8 ttp -57.72 -43.99 85.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.496 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.78 -46.58 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.553 -178.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.36 91.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.007 0.432 . . . . 0.0 110.352 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.569 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.7 mt -56.78 -43.16 80.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.565 -178.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -46.15 89.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.178 179.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.6 mtp85 -56.19 -42.35 77.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.206 -176.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.428 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.7 pt -89.47 14.07 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.92 23.13 70.03 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.282 172.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.428 ' NE ' HD12 ' A' ' 163' ' ' ILE . 88.3 mtt180 -97.12 88.13 4.4 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 117.516 0.658 . . . . 0.0 110.251 175.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -70.5 -49.01 52.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.32 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 85.2 p -55.95 -51.1 68.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.745 0.307 . . . . 0.0 111.207 -176.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.525 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.4 mt-10 -59.48 -39.0 82.28 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.904 -0.319 . . . . 0.0 110.97 -177.325 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.34 -47.92 82.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.894 0.378 . . . . 0.0 110.537 -177.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -55.62 -44.78 77.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.896 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.87 -49.91 75.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.247 -179.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.79 -48.11 84.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.984 -0.287 . . . . 0.0 110.605 -178.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -53.54 -49.07 68.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.325 -178.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -56.02 -39.25 71.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.982 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -62.41 -38.78 91.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.98 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 79.9 mt -58.59 -34.15 70.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.554 -179.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -54.76 -38.09 66.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.645 0.26 . . . . 0.0 111.239 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -139.32 132.3 29.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.789 0.328 . . . . 0.0 110.814 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -134.82 154.55 51.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.542 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -106.34 130.24 54.21 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -96.84 -68.56 0.79 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.887 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -110.0 141.13 43.21 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.727 -178.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 C--O 1.219 -0.508 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.599 179.615 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.7 ttm . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -121.42 135.8 60.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.959 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.2 144.46 56.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.665 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.6 p -135.81 144.89 32.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.221 179.863 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.0 t -94.04 143.57 26.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.633 -179.605 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -54.62 -35.36 63.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.373 179.861 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.94 77.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.671 0.272 . . . . 0.0 111.033 -178.742 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.2 mmm -56.32 -43.99 79.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.851 0.357 . . . . 0.0 110.714 -179.437 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.4 mt -56.2 -48.74 75.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.858 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.64 -49.04 79.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.289 -176.646 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.08 -53.49 49.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.39 -178.554 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.7 -44.74 81.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -178.825 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.14 -39.54 86.69 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.662 -179.18 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -58.06 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.94 0.4 . . . . 0.0 110.318 -178.774 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.4 -47.42 86.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.435 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.09 91.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.668 -178.983 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -59.35 -43.18 92.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.842 -178.371 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -59.11 -46.32 88.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.09 0.472 . . . . 0.0 110.095 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -125.72 108.88 11.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.33 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.16 -11.88 27.37 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 178.54 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.82 14.95 14.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.2 t -108.25 94.73 13.87 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.206 -0.426 . . . . 0.0 110.285 178.485 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -48.76 -34.53 27.98 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.411 1.407 . . . . 0.0 113.053 -175.276 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -58.03 -55.43 35.06 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.593 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.83 83.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.574 -179.042 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.41 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.1 mm-40 -59.81 -45.89 90.92 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.665 -178.924 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.53 74.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.003 0.43 . . . . 0.0 110.544 -176.297 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.82 92.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.307 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -59.17 -44.35 92.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.928 0.394 . . . . 0.0 110.834 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.489 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.7 m-85 -57.73 -46.61 84.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.132 -178.765 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -58.55 -45.93 87.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.676 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.3 -44.51 88.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.542 -178.039 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.6 mt -60.96 -41.06 95.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.859 -176.807 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.464 HD12 HD22 ' A' ' 155' ' ' LEU . 12.6 mt -63.93 -46.11 86.22 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.611 179.818 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.79 -40.56 84.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.029 -177.677 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -84.85 15.99 3.62 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 61.75 50.86 4.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.792 177.01 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.9 49.15 3.0 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.275 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.52 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.0 Cg_endo -57.51 -39.75 86.19 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 121.111 1.207 . . . . 0.0 111.765 -174.755 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.6 -37.94 68.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.0 -179.65 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.9 79.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.001 0.429 . . . . 0.0 110.176 -179.075 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.36 -42.72 68.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.247 179.249 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 44.8 t -65.57 -52.23 53.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.5 -177.618 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.1 m -54.87 -39.06 68.27 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.883 0.373 . . . . 0.0 111.191 -176.526 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -71.86 -52.72 16.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.592 -178.928 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.29 -32.91 65.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -176.228 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -76.81 -12.21 59.94 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.009 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 27.0 m -83.44 107.82 11.21 Favored Pre-proline 0 CA--C 1.535 0.385 0 CA-C-O 118.669 -0.681 . . . . 0.0 110.338 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.61 -16.62 25.05 Favored 'Trans proline' 0 N--CA 1.501 1.947 0 C-N-CA 121.249 1.299 . . . . 0.0 113.516 -174.689 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.03 -22.9 77.34 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.842 -177.1 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.9 140.77 18.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.567 0.683 . . . . 0.0 110.28 -176.305 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.41 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.51 156.05 20.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.569 0.699 . . . . 0.0 111.749 -176.99 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.0 p -142.23 137.89 31.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.405 176.53 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.9 p -126.02 163.23 40.95 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.522 177.801 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.08 -45.26 18.18 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.43 1.42 . . . . 0.0 112.472 178.728 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.33 -43.31 88.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.308 177.964 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.6 m -59.81 -41.51 91.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.554 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.07 -45.21 87.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.372 -178.28 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.73 -45.45 89.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.13 0.491 . . . . 0.0 110.207 179.725 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.489 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.3 mt -59.03 -40.94 86.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.712 -179.729 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.537 ' CE2' HD11 ' A' ' 160' ' ' LEU . 57.4 t80 -58.78 -47.24 85.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.127 0.489 . . . . 0.0 110.256 179.779 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.2 ttp -57.95 -44.8 87.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.42 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.45 -45.15 89.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.538 -178.077 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.54 93.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.049 0.452 . . . . 0.0 110.496 -178.241 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.537 HD11 ' CE2' ' A' ' 156' ' ' TYR . 92.2 mt -56.56 -41.96 77.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.589 -178.958 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -60.7 -45.78 92.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.445 178.687 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 -56.19 -41.03 74.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.178 -177.111 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.52 HG23 ' HB2' ' A' ' 134' ' ' PRO . 36.0 pt -86.48 14.03 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -175.517 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.54 20.0 79.77 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 121.502 -0.38 . . . . 0.0 113.182 174.504 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -97.16 86.01 3.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.696 0.748 . . . . 0.0 109.848 177.39 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -71.81 -47.53 52.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.843 -174.364 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.0 t -55.86 -51.18 68.45 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.499 -173.734 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -64.84 -37.16 86.68 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.986 -176.861 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -60.61 -46.95 88.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.94 0.4 . . . . 0.0 110.3 -178.589 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -56.53 -45.13 81.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.808 179.686 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.83 -48.13 80.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.171 -178.828 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 47.2 t -59.81 -46.95 93.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.658 0.266 . . . . 0.0 110.662 -179.266 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -53.1 -44.58 67.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.413 -178.56 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -55.98 -39.41 71.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.899 179.226 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -62.53 -39.87 94.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.76 179.212 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.87 147.52 28.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.52 179.619 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -126.45 157.69 37.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.586 -179.71 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -108.19 143.11 37.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.55 179.906 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -111.8 136.71 50.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.583 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -109.17 142.31 40.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.492 179.857 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -56.89 -41.24 77.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.684 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -107.28 141.51 38.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.492 -179.841 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.6 179.975 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 55.2 ttp . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.5 t -64.91 132.54 30.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.118 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.05 148.86 46.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.577 -179.866 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -95.87 129.24 46.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.95 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 95.6 p -94.01 136.81 33.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.723 -179.24 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 27.5 p-80 -77.72 -20.18 53.96 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 178.835 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.97 -34.7 72.1 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 122.322 -0.236 . . . . 0.0 111.452 -177.702 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 72.8 mtm -54.93 -51.37 66.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.789 0.328 . . . . 0.0 111.198 -178.017 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.4 -48.01 75.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.96 -178.634 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.04 79.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.372 -176.343 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.33 -51.79 61.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.907 0.384 . . . . 0.0 111.344 -178.217 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -56.8 -46.11 81.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.002 -179.037 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -59.83 -40.01 87.04 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.582 -179.033 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.34 -45.78 87.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.323 -178.482 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -60.29 -46.66 89.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.563 -178.681 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.05 89.52 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 -179.511 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 56.2 t-20 -59.05 -43.41 91.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.026 -177.802 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -60.07 -47.31 86.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.951 0.405 . . . . 0.0 110.133 -179.481 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -121.92 108.85 13.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.383 178.151 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.4 mt -95.65 -11.88 26.47 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 178.429 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 80.0 p -92.36 15.07 14.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.152 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.9 t -109.09 94.79 15.84 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.208 178.249 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -48.87 -35.19 30.59 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.411 1.407 . . . . 0.0 112.92 -175.437 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -57.77 -54.93 41.33 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.667 -179.659 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.7 81.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.576 -179.02 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.413 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 44.8 mm-40 -59.82 -47.05 87.29 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.689 -179.191 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.43 -46.34 73.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.883 0.373 . . . . 0.0 110.583 -175.976 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.53 91.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.245 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -58.63 -44.57 90.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.854 -179.15 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.445 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.2 m-85 -57.71 -46.76 83.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.327 0.584 . . . . 0.0 110.114 -178.504 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -58.46 -46.41 86.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.678 -178.136 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 44.6 mt -58.67 -44.34 90.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.544 -178.088 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.4 mt -61.4 -40.68 95.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.946 -176.643 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.467 HD11 ' O ' ' A' ' 155' ' ' LEU . 18.6 mt -64.92 -46.14 82.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.655 179.879 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.45 -39.71 84.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.693 0.283 . . . . 0.0 111.101 -177.792 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.3 m -85.64 16.42 3.94 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -176.774 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 58.3 t30 62.18 50.85 3.75 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.464 0.65 . . . . 0.0 110.848 176.705 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.95 48.68 2.73 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.397 177.573 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.499 ' HB2' HG23 ' A' ' 163' ' ' ILE . 19.1 Cg_endo -57.3 -39.38 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.133 1.222 . . . . 0.0 111.694 -174.568 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.95 -38.18 69.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.021 -179.12 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -69.38 -41.61 76.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.905 0.383 . . . . 0.0 110.016 -179.047 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.6 t -55.34 -42.82 68.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.153 179.179 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -66.4 -52.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.646 -177.541 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 85.0 p -54.64 -37.7 65.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.832 0.349 . . . . 0.0 111.205 -176.666 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.92 -54.02 9.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.54 -179.077 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.64 -30.91 63.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.838 0.311 . . . . 0.0 111.838 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.81 -16.03 59.56 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.959 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 9.2 m -81.25 107.91 9.11 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.218 -179.7 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -57.62 -16.39 24.2 Favored 'Trans proline' 0 N--CA 1.502 1.994 0 C-N-CA 121.13 1.22 . . . . 0.0 113.501 -174.384 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -23.4 77.06 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 121.296 -0.478 . . . . 0.0 112.913 -177.074 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.23 140.73 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 117.51 0.655 . . . . 0.0 110.362 -176.076 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.413 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.48 156.05 20.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.637 0.732 . . . . 0.0 111.8 -176.95 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.1 p -144.15 137.89 27.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.418 176.237 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.2 p -125.55 163.53 38.17 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.259 177.671 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -45.97 -45.11 18.03 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 121.527 1.485 . . . . 0.0 112.456 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.34 -44.12 88.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.271 177.903 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.53 -41.23 89.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.545 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.04 -45.22 87.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.952 0.406 . . . . 0.0 110.427 -178.069 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -58.73 -45.79 88.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.138 0.494 . . . . 0.0 110.223 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.467 ' O ' HD11 ' A' ' 129' ' ' LEU . 41.6 mt -58.72 -41.64 86.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.536 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.535 ' CE2' HD11 ' A' ' 160' ' ' LEU . 45.5 t80 -58.63 -46.06 87.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.162 0.506 . . . . 0.0 110.375 179.661 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -58.08 -44.38 87.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.453 -178.995 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.74 -47.01 86.09 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.42 -177.952 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.72 90.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.063 0.458 . . . . 0.0 110.374 -178.409 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.535 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.7 mt -56.33 -43.47 79.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.594 -178.655 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.48 -46.47 88.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.228 179.715 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -56.73 -40.79 76.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.263 -176.896 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.499 HG23 ' HB2' ' A' ' 134' ' ' PRO . 41.0 pt -88.5 14.08 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.118 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.71 19.35 79.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.423 -0.418 . . . . 0.0 113.371 174.422 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.402 ' HD2' HD11 ' A' ' 163' ' ' ILE . 93.2 mtt180 -97.14 86.08 3.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 117.659 0.73 . . . . 0.0 110.17 176.78 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 46.4 p-80 -70.83 -45.81 63.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.364 -177.097 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.0 m -55.95 -51.08 68.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.893 0.378 . . . . 0.0 111.17 -176.518 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.47 ' OE1' HD22 ' A' ' 160' ' ' LEU . 92.8 mt-10 -59.15 -38.98 81.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.981 -177.725 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.21 -47.97 82.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.895 0.379 . . . . 0.0 110.539 -177.688 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -55.35 -44.99 76.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.966 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.86 -49.41 76.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.242 -179.182 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.402 HG21 ' CE2' ' A' ' 156' ' ' TYR . 50.7 t -57.26 -48.14 82.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.651 -178.769 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 58.8 ttt85 -53.51 -50.06 66.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.348 -178.296 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -57.64 -40.52 79.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.711 179.185 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -56.97 -39.33 74.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.937 -179.691 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 83.4 mt -56.18 -36.52 68.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.182 -179.74 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -56.05 -46.04 79.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.731 0.301 . . . . 0.0 110.887 -178.979 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -148.84 144.86 27.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.825 0.345 . . . . 0.0 110.666 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -84.12 134.85 34.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.591 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -134.14 124.25 25.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.478 179.579 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -60.35 -43.65 96.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.596 179.84 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -57.17 -41.15 78.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.699 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.559 -179.942 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -105.73 132.7 52.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.022 -179.98 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.23 151.03 27.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.565 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.7 m -127.49 142.47 43.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.388 179.736 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.0 t -94.05 113.08 24.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.584 -179.721 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -66.73 -36.32 82.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.217 179.367 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.95 -39.26 81.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.662 0.267 . . . . 0.0 110.876 -178.452 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp -56.46 -45.78 80.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 0.0 110.674 -179.658 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.43 -47.06 79.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.841 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.07 79.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.187 -176.63 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.54 -52.74 58.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.932 0.396 . . . . 0.0 111.341 -178.469 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.29 -44.94 80.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.078 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -59.81 -40.25 87.75 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.709 -178.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -58.27 -44.96 88.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.402 . . . . 0.0 110.346 -178.738 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -60.5 -46.19 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.571 -179.313 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.32 86.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.523 -179.218 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -59.27 -41.19 88.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.35 -46.93 87.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.054 0.454 . . . . 0.0 109.936 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -124.61 106.78 10.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.179 177.289 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -94.22 -11.86 29.43 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 178.947 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.06 14.97 14.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.557 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.02 94.84 15.75 Favored Pre-proline 0 CA--C 1.533 0.326 0 O-C-N 122.07 -0.394 . . . . 0.0 110.339 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.82 -32.8 23.39 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 121.362 1.374 . . . . 0.0 113.011 -175.279 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.23 -55.46 34.62 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.565 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.32 82.83 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.604 -179.257 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.416 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 41.3 mm-40 -59.86 -46.1 90.37 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.396 -0.522 . . . . 0.0 109.693 -179.032 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.9 -46.15 74.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 110.484 -176.174 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.87 92.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.264 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -59.11 -44.96 92.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.877 -179.192 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 125' ' ' TYR . . . . . 0.507 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.5 m-85 -57.72 -46.25 84.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.298 0.57 . . . . 0.0 110.09 -178.677 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -58.19 -47.04 84.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.57 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.2 mt -58.16 -43.4 87.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.527 -177.693 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.3 mt -61.07 -41.26 96.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.94 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.461 HD12 HD22 ' A' ' 155' ' ' LEU . 14.2 mt -64.59 -46.1 84.14 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.521 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -58.25 -40.82 82.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.014 -177.651 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.7 m -85.73 16.11 4.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.416 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 22.6 m120 61.63 51.63 3.92 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.474 0.654 . . . . 0.0 110.718 176.803 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -124.82 50.39 3.99 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.113 178.032 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.516 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.7 Cg_endo -56.87 -40.47 83.96 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.184 1.256 . . . . 0.0 111.591 -175.614 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.7 -37.15 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.147 -179.667 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -69.04 -42.27 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.938 0.399 . . . . 0.0 110.154 -178.67 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 54.4 t -55.29 -41.88 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.249 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 57.9 t -65.7 -53.37 39.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.536 -178.481 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 84.7 p -54.37 -38.11 65.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.942 0.401 . . . . 0.0 111.283 -176.017 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.2 ttt85 -72.97 -53.65 10.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.599 -179.051 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.52 -29.35 64.26 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.028 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.89 -14.28 59.9 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.738 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.6 m -84.79 107.22 10.66 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.25 179.686 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.46 -14.53 21.03 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.208 1.272 . . . . 0.0 113.586 -174.384 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.92 -23.51 76.94 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.302 -0.475 . . . . 0.0 112.919 -177.633 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -98.35 139.97 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 117.483 0.642 . . . . 0.0 110.297 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.416 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.19 156.06 19.33 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.76 -176.746 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 66.4 p -141.84 137.95 31.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.356 176.56 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 78.0 p -125.95 163.5 39.08 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.447 177.985 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -46.24 -45.64 18.05 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 121.446 1.431 . . . . 0.0 112.262 178.33 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.22 -44.68 88.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.371 177.966 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 152' ' ' CYS . . . . . 0.405 ' HA ' HD12 ' A' ' 155' ' ' LEU . 59.1 m -59.24 -41.55 88.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.408 . . . . 0.0 110.585 -179.454 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.15 -45.18 87.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.434 -177.849 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.12 -45.65 90.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.153 0.501 . . . . 0.0 110.322 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.507 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.0 mt -57.63 -42.89 84.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.425 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 156' ' ' TYR . . . . . 0.529 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.2 t80 -59.54 -47.41 85.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.292 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 157' ' ' MET . . . . . 0.48 ' HA ' HD12 ' A' ' 160' ' ' LEU . 61.3 ttp -56.95 -43.04 81.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.638 -177.665 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -60.08 -49.14 78.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -178.459 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.08 -41.29 83.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.0 0.429 . . . . 0.0 110.496 -177.883 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 160' ' ' LEU . . . . . 0.529 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 60.1 mt -57.05 -44.19 82.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.363 -179.077 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.55 -44.4 93.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.358 178.37 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -55.19 -42.0 72.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.122 -177.417 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 163' ' ' ILE . . . . . 0.516 HG23 ' HB2' ' A' ' 134' ' ' PRO . 37.3 pt -89.33 14.02 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.875 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.82 16.53 79.9 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.331 -0.462 . . . . 0.0 113.429 174.434 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -97.04 89.67 4.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 117.765 0.783 . . . . 0.0 110.047 176.896 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 32.9 p80 -76.48 -42.33 44.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.618 -175.29 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.2 t -55.92 -51.15 68.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 0.0 111.204 -175.387 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -60.96 -39.5 89.77 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.855 -177.477 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.16 -46.88 87.01 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.662 -177.325 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -55.8 -45.72 78.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.848 0.356 . . . . 0.0 110.94 -179.891 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.52 76.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.243 -179.075 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 47.6 t -59.17 -45.96 92.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.659 0.266 . . . . 0.0 110.597 -178.621 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 56.6 ttt85 -53.32 -50.0 65.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.353 -178.258 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -55.91 -40.01 72.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.931 179.369 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -64.23 -35.47 80.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.34 179.597 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 83.3 mt -89.33 39.91 0.96 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.068 0.461 . . . . 0.0 110.94 -178.983 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -57.19 -35.57 69.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.322 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -54.47 -38.96 67.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.704 0.288 . . . . 0.0 111.212 -178.359 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -96.45 136.9 36.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.618 -179.553 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -102.92 130.45 49.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.515 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -91.32 -40.52 11.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.701 179.77 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 79.5 m80 -130.99 143.59 50.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.483 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 . . . . . 0 C--O 1.221 -0.435 0 CA-C-O 117.887 -1.054 . . . . 0.0 110.573 179.787 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.3 mtp . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.833 0.349 . . . . 1.55 110.939 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.9 mt -56.15 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.48999999999999999 110.804 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.03 79.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.333 -0.394 . . . . 0.20000000000000001 111.295 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.5 m -53.5 -52.29 60.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 0.20999999999999999 111.395 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -45.16 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.31 -0.404 . . . . 1.96 110.928 -179.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.11 -40.41 89.59 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.794 -0.362 . . . . 1.1499999999999999 110.67 -178.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.38 -44.56 88.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 1.8100000000000001 110.32 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.24 -45.52 92.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.13 -0.486 . . . . 2.02 110.53 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.59 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 0.13 110.589 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -59.04 -41.34 87.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 1.8999999999999999 110.923 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -58.81 -45.62 89.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.178 0.513 . . . . 2.5800000000000001 110.062 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -127.24 106.65 9.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 1.1299999999999999 110.225 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.1 mt -93.72 -11.89 30.45 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.806 0.669 . . . . 0.14999999999999999 112.806 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -92.29 14.98 14.76 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.894 0.702 . . . . 0.16 112.894 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.4 t -109.11 94.83 15.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 119.197 -0.43 . . . . 0.20000000000000001 110.298 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -48.78 -31.69 20.17 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.422 1.414 . . . . 0.13 113.213 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.72 -56.18 25.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.889 0.376 . . . . 2.02 110.591 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.86 -40.55 80.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 0.080000000000000002 110.536 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.457 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 38.8 mm-40 -59.77 -47.47 85.57 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.628 -0.508 . . . . 0.10000000000000001 109.628 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.16 73.6 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 0.10000000000000001 110.483 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.51 -45.48 91.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.869 -0.605 . . . . 0.089999999999999997 110.297 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -59.63 -43.5 93.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.462 -0.335 . . . . 0.10000000000000001 110.857 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.498 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.2 m-85 -57.41 -46.23 83.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.377 0.608 . . . . 0.10000000000000001 110.088 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -46.15 88.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.717 -0.674 . . . . 1.6200000000000001 110.721 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.5 mt -58.11 -43.86 87.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.044 -0.525 . . . . 0.46000000000000002 110.578 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.02 -41.6 96.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.11 110.973 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.471 HD12 HD22 ' A' ' 155' ' ' LEU . 15.1 mt -64.3 -46.07 85.19 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.495 -0.482 . . . . 0.17000000000000001 110.619 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -58.98 -40.06 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.495 -0.32 . . . . 1.8200000000000001 111.021 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.5 m -85.87 16.32 4.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.219 0.822 . . . . 0.13 113.219 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 62.04 50.79 3.9 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.496 0.665 . . . . 2.1000000000000001 110.752 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -124.92 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 115.954 -0.566 . . . . 0.14999999999999999 111.397 177.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -57.57 -39.42 88.54 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.142 1.228 . . . . 0.13 111.663 -175.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.99 -37.86 69.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.294 -0.412 . . . . 2.0800000000000001 110.987 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.0 -42.77 80.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.985 0.421 . . . . 0.27000000000000002 109.945 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.9 t -55.45 -41.62 63.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.523 . . . . 0.13 110.306 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . 0.504 HG11 ' NH1' ' A' ' 165' ' ' ARG . 61.5 t -66.83 -54.67 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 0.20999999999999999 110.679 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 89.9 p -54.84 -38.92 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.034 0.445 . . . . 1.23 111.259 -175.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 64.5 ttt-85 -73.04 -50.27 23.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 0.70999999999999996 111.75 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -56.95 -33.23 66.83 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.947 -0.301 . . . . 0.20000000000000001 111.609 -176.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -76.86 -8.43 57.32 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.459 0.911 . . . . 1.6200000000000001 113.459 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.2 m -84.41 107.26 10.41 Favored Pre-proline 0 CA--C 1.536 0.413 0 CA-C-O 118.714 -0.66 . . . . 0.20000000000000001 110.175 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.7 -15.23 20.05 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 121.242 1.295 . . . . 0.22 113.575 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.68 77.23 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 121.221 -0.514 . . . . 0.17999999999999999 112.953 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -99.4 142.0 15.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-N 117.569 0.684 . . . . 0.14000000000000001 110.471 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.457 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.74 156.13 28.07 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.65 -0.705 . . . . 0.13 111.725 -177.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 63.3 p -140.88 137.82 33.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.333 -0.849 . . . . 0.19 110.506 176.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.8 p -125.77 163.18 40.74 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.666 -0.697 . . . . 0.38 109.517 177.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -46.04 -45.83 17.1 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.542 1.495 . . . . 0.20999999999999999 112.331 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.29 -43.4 88.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 2.04 110.344 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.61 -41.62 90.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.939 0.4 . . . . 0.14000000000000001 110.551 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.18 -45.79 86.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.989 0.423 . . . . 0.20000000000000001 110.387 -178.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.73 -45.17 90.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.517 . . . . 1.1100000000000001 110.288 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.498 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.2 mt -58.41 -43.06 88.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.246 0.546 . . . . 0.16 110.45 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.52 -45.25 89.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.039 -0.528 . . . . 0.26000000000000001 110.402 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.29 -45.03 84.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.03 -0.532 . . . . 0.52000000000000002 110.468 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.33 -46.34 86.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.092 -0.504 . . . . 1.8500000000000001 110.448 -178.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.29 90.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.12 110.348 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.38 -42.79 78.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 0.16 110.613 -178.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.76 -47.39 84.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 1.02 110.227 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -56.32 -41.68 76.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.874 -0.603 . . . . 1.8899999999999999 111.338 -176.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.6 pt -89.54 13.95 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 113.574 0.953 . . . . 0.16 113.574 -175.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 69.32 25.3 75.59 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 121.366 -0.445 . . . . 0.19 113.027 173.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . 0.504 ' NH1' HG11 ' A' ' 138' ' ' VAL . 95.7 mtt180 . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 117.359 0.579 . . . . 2.0499999999999998 110.211 176.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.2 mtp . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.936 0.398 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.9 mt -56.32 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.787 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.12 78.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.282 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.5 -52.97 57.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.302 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.87 -44.35 82.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.014 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.41 -40.13 89.89 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.665 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.82 -44.5 86.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.877 0.37 . . . . 0.0 110.382 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -61.52 -48.04 82.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.541 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.69 90.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 -179.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.3 t-20 -61.45 -44.95 96.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.082 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -59.43 -45.28 92.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.988 0.423 . . . . 0.0 110.179 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -125.36 109.47 12.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.318 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 146' ' ' ILE . 28.0 mt -96.76 -11.96 24.33 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -89.09 13.72 12.41 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.5 t -107.99 94.78 13.41 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.19 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -48.84 -36.06 32.69 Favored 'Trans proline' 0 N--CA 1.497 1.695 0 C-N-CA 121.366 1.378 . . . . 0.0 113.057 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.38 -54.43 46.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.3 84.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.557 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.56 -46.42 88.95 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.695 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.71 -46.73 74.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.944 0.402 . . . . 0.0 110.472 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.39 93.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.217 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -59.18 -45.02 92.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.976 0.417 . . . . 0.0 110.839 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.6 m-85 -57.63 -46.4 84.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.254 0.55 . . . . 0.0 110.084 -178.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -58.69 -46.34 87.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.674 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.2 mt -58.33 -43.97 88.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.566 -178.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.27 -41.21 96.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.957 -176.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.457 HD12 HD22 ' A' ' 155' ' ' LEU . 14.3 mt -64.11 -46.06 85.88 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.588 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -58.64 -40.98 84.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.759 0.314 . . . . 0.0 110.973 -177.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.2 m -84.58 15.3 3.85 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.4 t30 62.55 50.37 3.61 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.467 0.651 . . . . 0.0 110.87 177.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -124.85 49.33 3.14 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.353 177.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.479 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.1 Cg_endo -57.19 -39.08 93.15 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.116 1.211 . . . . 0.0 111.751 -174.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.98 -38.06 69.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -68.43 -42.3 79.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.027 0.442 . . . . 0.0 110.08 -179.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.42 -42.77 69.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.181 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -65.97 -52.31 50.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.593 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 86.5 p -54.91 -38.02 67.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.836 0.351 . . . . 0.0 111.199 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -72.44 -53.74 11.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.553 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -56.65 -31.6 64.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -76.82 -13.98 59.95 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -82.32 107.9 10.2 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.201 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -57.56 -16.35 23.74 Favored 'Trans proline' 0 N--CA 1.501 1.946 0 C-N-CA 121.238 1.292 . . . . 0.0 113.484 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.52 77.17 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 121.244 -0.503 . . . . 0.0 112.966 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.402 HG12 HD22 ' A' ' 115' ' ' LEU . 75.8 mt -100.02 141.4 17.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 117.57 0.685 . . . . 0.0 110.404 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.39 156.18 26.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.722 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -143.81 137.82 28.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.411 175.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -124.67 165.03 27.24 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.417 177.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -45.91 -44.83 18.17 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 C-N-CA 121.442 1.428 . . . . 0.0 112.508 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.39 -43.81 88.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.269 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.65 -41.22 90.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.646 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.05 -45.4 87.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.356 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.03 -45.97 89.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.127 0.489 . . . . 0.0 110.272 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.479 HD13 ' CB ' ' A' ' 125' ' ' TYR . 41.6 mt -58.24 -41.6 84.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.63 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.545 ' CE2' HD11 ' A' ' 160' ' ' LEU . 47.0 t80 -59.52 -46.51 88.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.454 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.7 ttp -57.57 -45.03 85.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.44 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.08 -46.16 88.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.501 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.51 92.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.545 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.1 mt -56.42 -43.55 79.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.99 0.424 . . . . 0.0 110.625 -178.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.75 -46.23 89.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.222 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 33.0 mtp85 -56.69 -40.65 75.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -176.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.479 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.6 pt -87.97 13.98 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -175.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.63 19.57 79.84 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.358 -0.449 . . . . 0.0 113.289 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . 0.417 ' HD2' HD11 ' A' ' 163' ' ' ILE . 84.1 mtt-85 . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 117.678 0.739 . . . . 0.0 110.138 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.3 mmm . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.849 0.357 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.72 -47.12 77.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.037 -178.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.95 -49.09 78.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.457 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.8 m -54.39 -52.29 62.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.95 0.405 . . . . 0.0 111.186 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -44.52 81.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.51 -40.52 91.73 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.679 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -58.34 -44.15 88.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.84 0.352 . . . . 0.0 110.409 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -61.02 -47.07 88.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.542 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.5 -46.23 89.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.676 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -59.49 -42.3 91.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.975 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.5 tttp -59.28 -46.52 88.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.079 0.466 . . . . 0.0 110.053 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -126.49 110.34 13.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.391 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.43 -11.95 26.74 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.13 14.91 14.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 18.9 t -108.13 94.81 13.78 Favored Pre-proline 0 CA--C 1.533 0.29 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.358 178.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -48.87 -34.66 29.08 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.37 1.38 . . . . 0.0 113.071 -174.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.09 -55.2 38.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.894 0.378 . . . . 0.0 110.584 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.09 -41.67 84.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.593 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.422 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.4 mm-40 -59.72 -45.89 90.8 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.351 -0.54 . . . . 0.0 109.675 -178.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.73 75.24 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 110.466 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.15 -44.37 92.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.311 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.36 -44.87 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 110.776 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.4 m-85 -57.61 -46.39 84.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.277 0.56 . . . . 0.0 110.054 -178.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -45.51 90.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.732 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.6 mt -58.55 -44.66 89.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.513 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -61.11 -40.97 95.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.926 -176.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.511 HD12 HD22 ' A' ' 155' ' ' LEU . 14.9 mt -64.33 -46.04 85.22 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.583 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.07 -40.59 85.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.7 0.286 . . . . 0.0 110.981 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 63.7 m -85.36 17.14 3.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 61.53 50.9 4.3 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.424 0.631 . . . . 0.0 110.751 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.591 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.266 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.25 -39.5 89.6 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.134 1.222 . . . . 0.0 111.707 -174.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.5 -38.41 69.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.935 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.83 -41.88 77.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.969 0.414 . . . . 0.0 110.169 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.55 -42.45 68.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.205 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.6 t -66.44 -52.88 41.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.676 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.8 m -54.46 -38.3 66.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.925 0.393 . . . . 0.0 111.24 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -72.44 -53.62 11.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.487 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -56.46 -31.69 64.24 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.81 -13.19 60.04 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.0 m -84.29 107.73 11.93 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.266 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -57.59 -14.78 17.96 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 121.224 1.282 . . . . 0.0 113.57 -174.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -22.98 77.19 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.932 -177.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -100.02 140.74 18.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 117.49 0.645 . . . . 0.0 110.301 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.422 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.93 156.1 21.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.754 -176.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -141.79 137.88 31.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.477 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 92.8 p -125.64 163.51 38.45 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.361 177.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -46.0 -44.96 18.37 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.445 1.43 . . . . 0.0 112.488 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -58.76 -44.05 90.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.275 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 60.4 m -59.59 -41.28 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.544 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.81 -45.1 86.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.435 -178.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -59.17 -46.12 89.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.191 0.519 . . . . 0.0 110.272 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.511 HD22 HD12 ' A' ' 129' ' ' LEU . 37.0 mt -58.73 -41.6 86.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.621 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.524 ' CE2' HD11 ' A' ' 160' ' ' LEU . 38.8 t80 -59.14 -46.37 88.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.164 0.507 . . . . 0.0 110.394 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.5 ttp -57.21 -44.56 83.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.527 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.78 -46.65 87.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.511 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.13 -44.0 92.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.279 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.8 mt -56.32 -43.35 78.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 110.672 -178.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.37 -46.35 88.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.242 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -57.38 -40.7 78.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.288 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 43.7 pt -89.05 14.06 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.99 24.45 75.81 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.467 -0.397 . . . . 0.0 113.141 173.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 55.6 mtp85 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 117.515 0.658 . . . . 0.0 110.109 176.343 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.2 mtp . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.801 0.334 . . . . 0.0 110.716 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.418 HD23 ' HB3' ' A' ' 127' ' ' LEU . 34.7 mt -55.36 -49.71 71.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 -178.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.07 79.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.487 -175.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.4 m -54.24 -52.83 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 111.26 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 87.4 mmt-85 -57.2 -44.24 83.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.89 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -60.26 -40.47 90.45 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.614 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -58.58 -45.63 88.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.837 0.351 . . . . 0.0 110.398 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.92 -46.82 89.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.616 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.77 90.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -59.0 -43.11 91.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.921 -177.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.71 -47.2 87.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.026 0.441 . . . . 0.0 110.177 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -121.54 108.76 13.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.392 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.0 mt -95.93 -11.88 25.95 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.19 14.92 14.76 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.6 t -108.63 94.87 14.96 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.332 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -48.86 -35.3 30.78 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.373 1.382 . . . . 0.0 113.05 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.56 -55.14 38.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.877 0.37 . . . . 0.0 110.653 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.67 83.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.563 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -59.67 -45.87 90.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.349 -0.541 . . . . 0.0 109.753 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.98 -46.76 75.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.976 0.417 . . . . 0.0 110.386 -176.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.22 92.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.216 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -59.16 -44.98 92.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.85 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.486 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.3 m-85 -57.65 -46.4 84.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.319 0.58 . . . . 0.0 110.093 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -58.73 -46.34 87.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.638 -178.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.418 ' HB3' HD23 ' A' ' 104' ' ' LEU . 42.5 mt -58.19 -44.08 87.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 -178.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.4 mt -60.98 -40.99 95.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.467 HD12 HD22 ' A' ' 155' ' ' LEU . 14.8 mt -64.36 -46.09 84.95 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.596 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.87 -40.3 83.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.736 0.303 . . . . 0.0 110.996 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -85.7 16.24 4.12 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 29.5 m120 61.93 51.03 3.89 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.462 0.648 . . . . 0.0 110.715 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.83 49.99 3.67 Favored Pre-proline 0 CA--C 1.541 0.613 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.297 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.414 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.5 Cg_endo -56.85 -38.92 94.76 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.18 1.253 . . . . 0.0 111.5 -175.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.12 -38.02 70.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.007 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -68.06 -42.24 80.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.986 0.422 . . . . 0.0 110.122 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.53 -42.38 68.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.17 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.69 -53.34 39.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 -177.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.9 m -54.65 -38.13 66.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.88 0.372 . . . . 0.0 111.212 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.86 -53.38 11.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.521 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -57.69 -30.53 65.56 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.876 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -76.89 -14.27 59.9 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -177.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.5 m -82.66 107.6 9.65 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.199 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.1 -16.98 29.53 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.19 1.26 . . . . 0.0 113.438 -174.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.38 77.01 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.314 -0.47 . . . . 0.0 113.011 -177.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.85 140.37 18.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.52 0.66 . . . . 0.0 110.401 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.7 156.08 24.62 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.621 0.724 . . . . 0.0 111.76 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.3 p -145.29 137.94 26.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.416 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.29 165.02 28.51 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.548 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -45.84 -44.41 18.34 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.467 1.445 . . . . 0.0 112.549 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -59.17 -43.53 92.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.187 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 81.7 m -59.6 -41.43 90.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.606 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.12 -45.71 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.409 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.68 -45.4 89.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.313 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.486 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.3 mt -58.28 -42.51 86.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.509 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -58.8 -45.78 89.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.5 ttp -57.16 -44.33 83.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.503 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -59.09 -46.97 86.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.445 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.47 -43.04 88.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.444 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 92.9 mt -56.8 -43.87 81.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.498 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -45.73 90.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.15 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -56.04 -42.97 77.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.214 -176.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.454 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.2 pt -90.47 14.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -174.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.59 27.1 70.05 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.021 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . 0.454 ' NE ' HD12 ' A' ' 163' ' ' ILE . 85.8 mtt180 . . . . . 0 C--N 1.33 -0.239 0 CA-C-N 117.315 0.558 . . . . 0.0 110.156 175.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.817 0.342 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.512 HD11 ' OG ' ' A' ' 131' ' ' SER . 14.5 mt -53.35 -52.02 60.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.205 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.06 75.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.795 -174.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -53.57 -54.07 42.7 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.598 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.594 ' HD2' HD11 ' A' ' 127' ' ' LEU . 85.5 mtt180 -63.2 -38.26 90.48 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.844 -177.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -60.85 -39.47 89.25 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.529 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -59.24 -47.74 84.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.852 0.358 . . . . 0.0 110.194 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.81 -44.84 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.577 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.04 -47.55 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.621 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -59.5 -41.39 89.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.079 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.19 -47.63 85.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.085 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -121.62 109.72 15.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.32 178.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -94.65 -11.85 28.5 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.2 p -92.1 15.03 14.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -108.74 94.91 15.25 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 119.262 -0.399 . . . . 0.0 110.282 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -48.88 -36.77 34.9 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.319 1.346 . . . . 0.0 113.03 -175.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -57.19 -54.09 50.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.689 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.34 85.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.59 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.5 mm-40 -59.49 -45.54 91.39 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.758 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.41 -46.69 73.22 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 110.471 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.6 92.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.93 -44.25 94.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.936 0.398 . . . . 0.0 110.858 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.495 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.2 m-85 -57.4 -45.97 83.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.324 0.583 . . . . 0.0 110.034 -179.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 32.9 mttm -59.16 -44.68 92.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.659 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.594 HD11 ' HD2' ' A' ' 107' ' ' ARG . 13.3 mt -58.06 -46.39 85.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.312 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.7 mt -60.04 -40.64 90.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.973 -175.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.479 HD12 HD22 ' A' ' 155' ' ' LEU . 16.6 mt -65.14 -46.16 82.09 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.692 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.03 -39.44 81.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.755 0.312 . . . . 0.0 111.092 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.512 ' OG ' HD11 ' A' ' 104' ' ' LEU . 63.9 m -86.92 16.97 4.39 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -176.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 62.27 50.27 3.92 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.458 0.646 . . . . 0.0 110.824 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -124.88 49.46 3.25 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.171 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.481 ' HB2' HG23 ' A' ' 163' ' ' ILE . 20.0 Cg_endo -57.58 -39.37 88.89 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.123 1.215 . . . . 0.0 111.544 -175.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -56.03 -37.64 69.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.047 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.98 79.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 0.0 110.12 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.35 -41.88 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.23 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.12 -53.2 43.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.498 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.67 -38.35 66.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 111.234 -176.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -72.99 -53.2 11.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.605 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -57.47 -30.77 65.34 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.791 -175.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -76.93 -12.79 60.0 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -84.36 107.41 10.89 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.661 -0.685 . . . . 0.0 110.294 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.13 -15.71 24.32 Favored 'Trans proline' 0 N--CA 1.502 1.978 0 C-N-CA 121.229 1.286 . . . . 0.0 113.549 -174.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -22.82 77.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 121.262 -0.494 . . . . 0.0 112.873 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -99.3 140.33 18.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 117.608 0.704 . . . . 0.0 110.36 -176.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.07 156.13 22.26 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.584 0.707 . . . . 0.0 111.79 -176.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.6 p -141.63 137.87 32.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.413 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.1 p -124.57 163.45 36.63 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.419 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -46.08 17.37 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 121.453 1.435 . . . . 0.0 112.307 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.18 -42.84 86.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.25 -42.44 95.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.56 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -57.99 -44.32 87.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.029 0.442 . . . . 0.0 110.456 -178.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -59.04 -46.19 88.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.191 0.519 . . . . 0.0 110.179 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.495 HD13 ' CB ' ' A' ' 125' ' ' TYR . 41.8 mt -57.7 -42.17 83.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.404 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.8 t80 -59.25 -46.62 88.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.429 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.4 ttp -57.39 -44.04 84.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.526 -178.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.43 -46.81 87.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.494 -178.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.97 89.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.067 0.461 . . . . 0.0 110.465 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.404 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 92.8 mt -56.4 -43.74 79.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.61 -45.85 90.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.209 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -56.14 -41.52 75.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.256 -177.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.481 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.4 pt -88.51 14.19 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.53 22.2 79.1 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 121.373 -0.442 . . . . 0.0 113.206 174.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 117.58 0.69 . . . . 0.0 110.189 176.591 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.8 mtp . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.8 mt -56.39 -47.85 78.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.818 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.4 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.297 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.48 -53.06 56.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.891 0.377 . . . . 0.0 111.329 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -56.35 -44.47 80.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.076 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.56 -40.43 91.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.644 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -58.16 -44.4 87.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.383 . . . . 0.0 110.435 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.64 -47.53 85.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.439 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.29 -46.04 89.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.658 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -59.05 -42.58 90.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.88 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.25 -46.81 87.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.091 0.472 . . . . 0.0 110.07 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -124.42 108.67 12.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.262 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.415 HD22 HG12 ' A' ' 146' ' ' ILE . 90.6 mt -94.84 -11.85 28.07 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.9 15.01 13.97 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 16.7 t -108.83 94.92 15.47 Favored Pre-proline 0 CA--C 1.533 0.314 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.283 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -48.93 -34.96 30.34 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.344 1.362 . . . . 0.0 112.889 -175.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -57.68 -54.86 42.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.908 0.385 . . . . 0.0 110.672 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.95 84.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.557 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.435 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.0 mm-40 -59.42 -45.3 91.92 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.812 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.93 -47.46 74.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.911 0.386 . . . . 0.0 110.388 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.39 92.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.338 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -58.92 -44.9 91.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.462 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.4 m-85 -57.72 -46.47 84.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.338 0.589 . . . . 0.0 110.188 -178.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.619 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.6 mt -58.39 -44.31 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.496 -178.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.7 mt -61.48 -41.21 96.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.03 -176.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 155' ' ' LEU . 20.1 mt -64.17 -46.16 85.22 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -59.08 -40.66 85.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.107 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.2 m -84.82 16.12 3.52 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 61.76 51.14 3.99 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.547 0.689 . . . . 0.0 110.676 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.83 49.36 3.15 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.302 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.516 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.2 Cg_endo -56.63 -39.85 88.47 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.144 1.23 . . . . 0.0 111.588 -175.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -55.71 -38.22 69.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.065 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.26 -42.66 79.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.031 0.443 . . . . 0.0 110.094 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.39 -42.84 69.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.158 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.13 -52.09 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.578 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -54.57 -38.23 66.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.923 0.392 . . . . 0.0 111.259 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.2 ttt85 -72.57 -53.84 10.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.576 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -56.72 -31.28 64.36 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.59 59.99 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.6 m -83.7 107.54 10.58 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.214 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -57.78 -16.26 24.63 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 121.266 1.311 . . . . 0.0 113.573 -174.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.62 77.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.972 -177.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.415 HG12 HD22 ' A' ' 115' ' ' LEU . 73.0 mt -99.62 139.76 20.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 117.524 0.662 . . . . 0.0 110.34 -176.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.435 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.72 156.06 17.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.673 0.749 . . . . 0.0 111.635 -177.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.7 p -149.14 137.88 21.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.399 176.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 p -124.9 165.03 27.74 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.442 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -45.97 -44.77 18.45 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.472 1.448 . . . . 0.0 112.48 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -58.07 -44.47 87.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.987 0.422 . . . . 0.0 110.289 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.5 m -59.11 -41.41 88.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 24.3 mtp -57.71 -43.57 85.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.456 -178.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.71 -46.26 87.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.121 0.486 . . . . 0.0 110.169 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.462 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.5 mt -58.54 -41.9 86.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.532 ' CE2' HD11 ' A' ' 160' ' ' LEU . 47.9 t80 -58.75 -45.67 89.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.174 0.511 . . . . 0.0 110.358 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 59.7 ttp -58.62 -44.25 89.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.586 -179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.59 -45.74 88.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.47 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.4 91.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.345 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.532 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.6 mt -56.33 -42.9 78.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.689 -178.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.14 -46.85 87.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.214 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 22.0 mtp85 -56.12 -41.84 75.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.236 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.516 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.5 pt -88.39 13.95 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 70.24 24.18 76.81 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.398 -0.429 . . . . 0.0 113.056 174.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 117.47 0.635 . . . . 0.0 110.287 176.38 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 73.3 mtm . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.891 0.377 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.7 mt -56.43 -47.0 79.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.8 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.0 79.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.237 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.37 -53.24 53.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.907 0.384 . . . . 0.0 111.404 -178.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 83.1 mmt-85 -56.57 -44.09 80.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.055 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -60.43 -40.63 91.76 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.581 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.94 -43.96 86.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.97 0.414 . . . . 0.0 110.439 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -60.77 -47.91 84.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.478 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.12 -45.7 90.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.636 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -59.04 -42.88 91.3 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.819 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -59.29 -46.51 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.076 0.465 . . . . 0.0 109.991 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -125.68 109.08 12.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.386 177.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -95.27 -11.9 27.13 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -91.33 14.86 13.34 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.2 t -108.78 94.79 15.08 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-O 119.273 -0.394 . . . . 0.0 110.244 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.8 -34.75 28.89 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.302 1.335 . . . . 0.0 113.037 -175.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -57.71 -55.15 38.61 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.665 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.34 83.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.495 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.407 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.9 mm-40 -59.64 -46.09 90.04 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.668 -179.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.75 -46.82 74.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.95 0.405 . . . . 0.0 110.434 -176.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.52 -44.47 93.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.278 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.85 -44.95 91.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.489 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.8 m-85 -57.85 -46.62 84.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.267 0.556 . . . . 0.0 110.045 -178.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -58.63 -45.44 89.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.43 -44.97 89.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.553 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.15 -40.62 94.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.884 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.473 HD12 HD22 ' A' ' 155' ' ' LEU . 16.3 mt -64.34 -46.09 85.01 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.619 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -58.69 -40.93 85.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.015 -177.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.61 16.1 3.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 62.0 50.58 4.04 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.431 0.634 . . . . 0.0 110.78 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.85 49.4 3.19 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.167 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.507 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.9 Cg_endo -57.61 -38.55 93.17 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.091 1.194 . . . . 0.0 111.688 -174.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.09 -38.19 70.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.0 -42.5 80.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.017 0.437 . . . . 0.0 110.081 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.0 t -55.53 -42.81 69.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.204 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.92 -52.34 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.54 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.6 67.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 111.157 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.2 -53.19 13.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.55 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -56.55 -32.5 65.2 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.656 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -76.85 -11.34 59.81 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -85.01 107.34 11.35 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-O 118.753 -0.641 . . . . 0.0 110.253 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.79 -15.64 22.19 Favored 'Trans proline' 0 N--CA 1.502 1.998 0 C-N-CA 121.26 1.307 . . . . 0.0 113.499 -174.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.85 -22.6 77.01 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.972 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.7 mt -99.99 140.29 19.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.515 0.657 . . . . 0.0 110.339 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.407 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.7 156.1 17.61 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.593 0.711 . . . . 0.0 111.722 -176.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.81 137.88 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.465 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 95.8 p -125.98 163.35 40.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.391 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.02 -45.37 17.78 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.446 1.43 . . . . 0.0 112.422 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -58.26 -43.2 87.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.962 0.41 . . . . 0.0 110.369 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.4 m -59.98 -41.87 92.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.3 mtp -57.91 -44.8 87.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.964 0.411 . . . . 0.0 110.403 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.81 -45.75 89.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.303 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.489 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.5 mt -58.62 -40.91 84.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.615 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.556 ' CE2' HD11 ' A' ' 160' ' ' LEU . 53.2 t80 -59.46 -47.41 85.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.106 0.479 . . . . 0.0 110.495 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.1 ttp -57.65 -44.54 85.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.459 -178.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.26 -45.88 90.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.459 -177.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.95 -43.82 91.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.137 0.494 . . . . 0.0 110.496 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.556 HD11 ' CE2' ' A' ' 156' ' ' TYR . 92.8 mt -56.58 -43.29 79.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.535 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.83 -46.07 90.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.308 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -56.39 -40.81 75.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.225 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.507 HG23 ' HB2' ' A' ' 134' ' ' PRO . 39.6 pt -87.53 13.99 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.65 17.64 80.04 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 121.326 -0.464 . . . . 0.0 113.429 174.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt-85 . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 117.704 0.752 . . . . 0.0 110.097 176.952 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.9 mtp . . . . . 0 C--O 1.232 0.153 0 CA-C-O 121.014 0.435 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.0 mt -56.36 -44.55 80.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.739 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.2 m -53.48 -53.63 48.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.856 0.36 . . . . 0.0 111.306 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -56.47 -44.13 80.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.021 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -60.6 -40.56 92.23 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.657 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -57.94 -44.14 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.408 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.89 -48.0 83.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.568 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.75 90.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.686 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -60.27 -44.05 95.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.919 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -58.9 -45.23 90.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.059 0.457 . . . . 0.0 110.127 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -126.41 107.69 10.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.324 177.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.5 mt -95.03 -11.94 27.5 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.2 p -91.68 15.06 13.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -107.85 94.87 13.3 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 119.284 -0.388 . . . . 0.0 110.151 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -48.85 -34.43 28.26 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.413 1.408 . . . . 0.0 113.056 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -58.24 -55.21 37.98 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.587 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.41 82.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.609 -179.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.408 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.1 mm-40 -59.71 -46.36 89.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.756 -179.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.69 -46.79 74.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.921 0.391 . . . . 0.0 110.486 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.32 -45.21 91.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.263 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -59.13 -43.95 91.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.897 -178.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.497 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.8 m-85 -57.58 -46.23 84.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 110.15 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -59.05 -44.85 91.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.678 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.54 -45.28 89.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.528 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.9 mt -60.44 -41.11 93.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.5 HD12 HD22 ' A' ' 155' ' ' LEU . 16.3 mt -64.05 -46.15 85.64 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.666 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -58.85 -40.34 83.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.756 0.313 . . . . 0.0 111.147 -177.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.4 m -84.49 15.61 3.62 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 62.14 50.53 3.93 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.463 0.649 . . . . 0.0 110.727 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.93 49.44 3.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.228 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.486 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.1 Cg_endo -57.15 -39.67 88.88 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.135 1.224 . . . . 0.0 111.673 -175.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -55.46 -38.03 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.995 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.46 -42.42 78.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.943 0.402 . . . . 0.0 110.135 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.2 t -55.37 -42.25 66.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.25 -52.45 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.552 -177.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.74 -38.62 67.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 0.0 111.204 -176.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.1 ttt85 -72.21 -53.31 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.531 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -56.58 -31.6 64.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 -176.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -76.89 -12.62 59.98 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.4 m -84.66 107.44 11.33 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.149 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.91 -14.83 19.62 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 C-N-CA 121.232 1.288 . . . . 0.0 113.581 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -23.03 77.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 121.196 -0.526 . . . . 0.0 112.906 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -99.85 140.16 19.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 117.446 0.623 . . . . 0.0 110.235 -176.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.408 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.36 156.1 19.81 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.507 0.67 . . . . 0.0 111.65 -177.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.4 p -144.19 137.93 27.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.404 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.11 165.12 29.36 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.477 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -45.94 -44.31 18.85 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.442 1.428 . . . . 0.0 112.474 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -58.43 -44.86 89.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.962 0.41 . . . . 0.0 110.258 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.2 m -59.1 -41.62 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.458 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.77 -45.74 85.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.956 0.408 . . . . 0.0 110.39 -178.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -58.83 -45.67 89.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.216 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.5 HD22 HD12 ' A' ' 129' ' ' LEU . 38.1 mt -58.77 -41.06 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.68 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.562 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.3 t80 -59.53 -47.33 85.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.129 0.49 . . . . 0.0 110.456 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.6 ttp -57.53 -44.14 84.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.451 -178.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -59.3 -46.38 88.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.565 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.121 0.486 . . . . 0.0 110.415 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.562 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.8 mt -56.48 -43.25 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.642 -178.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.91 -46.27 89.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.379 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -56.41 -40.47 74.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.241 -177.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.486 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.0 pt -87.49 13.98 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 113.456 0.909 . . . . 0.0 113.456 -175.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 78.61 15.26 81.1 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 121.322 -0.466 . . . . 0.0 113.506 174.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . 0.433 ' HD2' HD11 ' A' ' 163' ' ' ILE . 86.8 mtt-85 . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 117.777 0.789 . . . . 0.0 110.144 177.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.1 mtp . . . . . 0 C--O 1.233 0.191 0 CA-C-O 120.933 0.397 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.6 mt -56.59 -44.4 81.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.759 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.04 79.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.334 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.31 -53.25 53.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.998 0.428 . . . . 0.0 111.346 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -56.86 -45.6 82.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.926 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -59.88 -39.28 84.76 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.761 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -58.06 -45.14 87.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.91 0.386 . . . . 0.0 110.336 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -60.29 -48.07 83.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.362 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.03 -45.87 89.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.603 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -59.32 -42.25 90.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -59.02 -46.33 88.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.022 0.439 . . . . 0.0 110.073 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -127.07 110.91 13.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.495 177.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 96.5 mt -94.13 -11.87 29.6 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 178.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.29 15.08 12.73 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.9 t -108.13 94.79 13.72 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.332 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.93 -39.09 39.85 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.381 1.387 . . . . 0.0 113.14 -175.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -56.81 -51.71 67.91 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.825 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.38 -42.99 92.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.568 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -59.3 -45.19 91.97 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.76 -179.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.22 -47.21 72.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.978 0.418 . . . . 0.0 110.454 -176.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.46 -44.93 92.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.21 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -58.76 -44.51 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 0.0 110.839 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.493 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.1 m-85 -57.65 -46.8 83.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.277 0.561 . . . . 0.0 110.041 -178.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -58.56 -46.04 87.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.697 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.31 -44.22 88.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.571 -178.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.3 mt -60.79 -41.28 95.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.866 -176.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.464 HD12 HD22 ' A' ' 155' ' ' LEU . 16.4 mt -64.47 -46.17 84.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.742 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -59.17 -39.82 83.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.056 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 73.6 m -84.76 15.4 3.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 62.46 50.1 3.81 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.499 0.666 . . . . 0.0 110.869 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -124.88 48.91 2.82 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.421 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.86 -38.27 93.17 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.147 1.231 . . . . 0.0 111.643 -175.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -56.22 -38.21 70.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.01 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.06 -42.12 80.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.044 0.45 . . . . 0.0 110.109 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.62 -43.25 72.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.145 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 45.8 t -65.95 -52.21 51.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.6 -177.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -55.02 -39.06 68.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.831 0.348 . . . . 0.0 111.092 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -72.36 -51.95 18.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.547 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -57.0 -31.62 65.28 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -76.89 -10.06 59.11 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 12.7 m -86.26 106.87 11.22 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.211 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -57.64 -15.0 18.85 Favored 'Trans proline' 0 N--CA 1.5 1.898 0 C-N-CA 121.311 1.341 . . . . 0.0 113.571 -174.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -23.25 77.11 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 121.286 -0.483 . . . . 0.0 112.872 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -98.64 139.77 19.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 117.542 0.671 . . . . 0.0 110.385 -176.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.14 156.1 19.04 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.665 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -144.6 137.84 27.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.515 176.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.86 164.97 29.86 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.414 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -45.81 -43.35 19.29 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 121.454 1.436 . . . . 0.0 112.488 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -59.88 -43.93 94.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.098 178.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.1 m -59.65 -41.46 90.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.572 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.3 mtp -58.13 -45.47 87.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.979 0.419 . . . . 0.0 110.342 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.51 -45.29 89.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.204 0.526 . . . . 0.0 110.231 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.493 HD13 ' CB ' ' A' ' 125' ' ' TYR . 38.7 mt -59.28 -41.22 88.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.611 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.541 ' CE2' HD11 ' A' ' 160' ' ' LEU . 49.1 t80 -58.08 -45.2 87.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.07 0.462 . . . . 0.0 110.218 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 16.5 ttm -57.74 -45.91 85.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -57.81 -45.26 86.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.513 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.75 91.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.969 0.414 . . . . 0.0 110.306 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.541 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.1 mt -56.59 -43.34 80.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.037 0.446 . . . . 0.0 110.532 -178.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.5 -44.39 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.391 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 18.0 mtp180 -56.42 -42.67 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.44 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.8 pt -88.49 14.15 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -174.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.9 23.34 69.57 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.276 -0.487 . . . . 0.0 113.305 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . 0.44 ' NE ' HD12 ' A' ' 163' ' ' ILE . 92.5 mtt180 . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 117.448 0.624 . . . . 0.0 110.172 175.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.836 0.35 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.6 mt -56.18 -49.65 73.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.824 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.0 -49.05 79.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.249 -176.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.4 m -53.4 -53.02 57.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.393 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -56.37 -44.3 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.992 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.04 -41.73 92.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.609 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -58.31 -44.03 88.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.79 0.329 . . . . 0.0 110.437 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.16 -47.12 87.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.547 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.52 -46.22 89.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.593 -179.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -59.7 -41.91 91.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -59.5 -46.88 87.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.134 0.492 . . . . 0.0 109.977 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -123.54 106.3 10.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.197 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -93.44 -12.0 30.81 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.26 15.0 14.66 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.6 t -108.03 94.84 13.6 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.351 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -48.75 -34.79 28.69 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.432 1.421 . . . . 0.0 113.155 -174.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.59 -54.91 41.77 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.621 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.1 83.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.53 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.46 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.1 mm-40 -59.77 -46.84 87.93 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.694 -178.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.79 -46.84 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.925 0.393 . . . . 0.0 110.518 -176.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.27 -44.68 92.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.65 -44.22 93.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.922 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.491 ' CB ' HD13 ' A' ' 155' ' ' LEU . 66.7 m-85 -57.65 -46.23 84.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.321 0.582 . . . . 0.0 110.117 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -59.3 -45.14 92.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.679 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.7 mt -59.05 -44.75 91.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.6 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.0 mt -61.11 -41.11 96.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.912 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.535 HD12 HD22 ' A' ' 155' ' ' LEU . 14.4 mt -64.17 -46.05 85.71 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.634 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.15 -40.57 85.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.713 0.292 . . . . 0.0 110.931 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.9 m -84.36 16.31 3.15 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 61.78 50.62 4.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.477 0.656 . . . . 0.0 110.842 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.86 48.58 2.64 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.58 -39.46 88.13 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 121.109 1.206 . . . . 0.0 111.773 -174.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -55.55 -38.21 68.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.04 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.37 -42.86 78.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.019 0.438 . . . . 0.0 109.992 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.3 t -55.3 -42.63 67.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.307 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.7 t -67.05 -53.62 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.716 -176.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 21.6 t -54.83 -39.37 68.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.973 0.416 . . . . 0.0 111.153 -176.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.6 ttt-85 -72.98 -50.47 23.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.692 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.6 -32.84 65.65 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.584 -177.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -76.93 -7.55 55.76 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -177.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 39.2 m -86.67 106.73 11.31 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.105 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_exo -57.42 -13.96 14.8 Favored 'Trans proline' 0 N--CA 1.502 2.002 0 C-N-CA 121.234 1.289 . . . . 0.0 113.667 -174.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -24.13 76.58 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.252 -0.499 . . . . 0.0 112.857 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.2 mt -98.01 142.04 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 117.386 0.593 . . . . 0.0 110.397 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.46 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.27 156.21 26.21 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.554 -177.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.1 p -146.19 137.86 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.543 176.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -123.56 165.09 24.64 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.365 177.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.91 -44.97 18.02 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.439 1.426 . . . . 0.0 112.509 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.44 -43.31 88.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.318 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.0 m -60.11 -42.86 95.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.865 0.364 . . . . 0.0 110.589 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -57.97 -43.4 86.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.441 -178.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -59.04 -46.45 88.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.146 0.498 . . . . 0.0 110.083 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.535 HD22 HD12 ' A' ' 129' ' ' LEU . 35.6 mt -58.52 -41.0 84.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.647 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.505 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 38.7 t80 -58.81 -45.35 90.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.084 0.469 . . . . 0.0 110.387 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 15.1 ttm -57.92 -45.82 85.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.407 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -57.84 -45.49 86.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.521 -176.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.15 -45.73 92.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.979 0.419 . . . . 0.0 110.402 -178.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.505 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 90.4 mt -56.65 -42.68 79.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.005 0.431 . . . . 0.0 110.629 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -60.99 -45.37 95.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.408 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.3 mtp180 -56.63 -41.36 77.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.114 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -87.44 13.99 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.89 21.36 79.84 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.428 -0.415 . . . . 0.0 113.265 173.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 117.626 0.713 . . . . 0.0 110.146 176.569 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.921 0.391 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.2 mt -56.49 -47.65 78.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.745 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -48.98 79.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.121 -177.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.03 -53.2 53.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.892 0.377 . . . . 0.0 111.474 -178.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 82.7 mmt-85 -56.28 -44.51 79.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.954 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -60.34 -39.93 88.87 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.68 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.99 -44.14 87.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.976 0.417 . . . . 0.0 110.389 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -60.88 -47.43 86.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.526 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.36 -45.39 91.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.664 -179.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.32 -42.83 92.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.905 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -59.51 -47.08 86.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.087 0.47 . . . . 0.0 109.982 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.4 108.81 12.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.302 177.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.9 mt -95.92 -11.92 25.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.33 14.76 13.62 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.0 t -108.53 94.78 14.55 Favored Pre-proline 0 CA--C 1.533 0.294 0 O-C-N 122.042 -0.411 . . . . 0.0 110.183 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.86 -34.37 28.12 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.431 1.421 . . . . 0.0 112.894 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.13 -55.33 36.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.816 0.341 . . . . 0.0 110.679 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.02 81.62 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.569 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.436 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.7 mm-40 -59.85 -46.46 89.22 Favored 'General case' 0 N--CA 1.461 0.12 0 C-N-CA 120.382 -0.527 . . . . 0.0 109.672 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.47 74.09 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.936 0.398 . . . . 0.0 110.506 -176.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.99 92.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.247 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -58.72 -45.01 90.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 110.869 -179.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.481 ' CB ' HD13 ' A' ' 155' ' ' LEU . 66.1 m-85 -57.64 -46.55 84.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.371 0.605 . . . . 0.0 110.104 -178.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.5 mttt -58.82 -45.59 89.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.757 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.8 mt -58.47 -44.47 89.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.522 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.16 -41.13 96.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.959 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.497 HD12 HD22 ' A' ' 155' ' ' LEU . 13.8 mt -64.1 -46.07 85.85 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.492 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.53 -41.44 85.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.738 0.304 . . . . 0.0 111.0 -177.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.52 16.11 3.35 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 61.88 51.18 3.87 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.474 0.654 . . . . 0.0 110.695 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -124.91 49.77 3.53 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.116 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.406 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.8 Cg_endo -56.42 -39.87 88.39 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 121.183 1.256 . . . . 0.0 111.575 -175.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.57 -38.1 68.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.114 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.32 -42.4 79.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.07 0.462 . . . . 0.0 110.117 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.75 -42.47 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.185 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.0 t -66.23 -52.19 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -177.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -54.54 -38.15 66.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.0 111.23 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.7 ttt85 -72.89 -53.94 10.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.499 -178.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -56.64 -31.21 64.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.35 60.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -84.67 107.06 9.98 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.207 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -58.16 -15.22 22.31 Favored 'Trans proline' 0 N--CA 1.501 1.912 0 C-N-CA 121.31 1.34 . . . . 0.0 113.571 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -23.55 76.99 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 121.305 -0.474 . . . . 0.0 112.856 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.9 mt -98.15 139.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 117.529 0.664 . . . . 0.0 110.362 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.436 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.32 156.05 16.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.693 0.759 . . . . 0.0 111.594 -176.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -143.33 137.95 29.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.348 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.5 p -125.35 163.48 38.07 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.304 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -45.96 -45.11 17.97 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 121.378 1.385 . . . . 0.0 112.476 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -58.36 -43.97 88.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.317 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.81 -41.5 91.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -57.91 -44.94 87.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.954 0.407 . . . . 0.0 110.442 -178.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.95 -46.22 88.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.248 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.497 HD22 HD12 ' A' ' 129' ' ' LEU . 40.6 mt -58.26 -40.83 82.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.678 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.52 ' CE2' HD11 ' A' ' 160' ' ' LEU . 43.1 t80 -59.37 -47.62 84.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.415 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.2 ttp -57.43 -42.93 83.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . 0.435 ' OE1' HD13 ' A' ' 129' ' ' LEU . 92.4 mt-10 -59.22 -47.38 85.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.543 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.77 -43.45 90.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.019 0.437 . . . . 0.0 110.364 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.52 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.7 mt -56.68 -43.77 80.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.588 -178.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.3 -46.04 89.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.151 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.4 mtp85 -56.42 -42.19 77.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.284 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.421 HD12 ' NE ' ' A' ' 165' ' ' ARG . 38.3 pt -89.47 14.16 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -174.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.65 25.59 69.56 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.309 -0.472 . . . . 0.0 113.154 173.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . 0.421 ' NE ' HD12 ' A' ' 163' ' ' ILE . 87.9 mtt180 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 117.448 0.624 . . . . 0.0 110.109 175.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 95.0 mmm . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.908 0.385 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.9 mt -56.09 -45.86 79.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.831 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.04 78.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.367 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.19 -52.86 57.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.971 0.415 . . . . 0.0 111.344 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -56.86 -46.14 81.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.014 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.99 -39.01 84.27 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.752 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -57.89 -45.2 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.48 -47.12 87.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.481 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.52 89.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.628 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.46 -42.2 91.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -58.85 -45.5 89.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.126 0.489 . . . . 0.0 110.098 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -126.22 104.85 8.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.117 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 97.1 mt -90.6 -11.86 38.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.75 15.05 15.45 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 2.9 t -107.41 94.88 12.37 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.251 -0.404 . . . . 0.0 110.376 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -48.8 -39.2 38.91 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.447 1.431 . . . . 0.0 113.37 -174.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -57.33 -49.57 75.71 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.78 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.13 98.5 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.39 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.453 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 46.3 mm-40 -59.06 -45.82 89.82 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.61 -47.31 73.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.422 -176.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.49 91.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.311 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -59.66 -44.29 93.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 110.931 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.5 m-85 -57.58 -46.41 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.352 0.596 . . . . 0.0 110.111 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -58.98 -45.22 91.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.709 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.9 mt -58.35 -44.92 88.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.575 -178.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -60.79 -41.65 96.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.926 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.568 HD12 HD22 ' A' ' 155' ' ' LEU . 15.2 mt -63.74 -46.13 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.621 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -58.6 -41.06 84.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.986 -177.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.3 m -84.42 15.67 3.54 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 61.98 50.76 3.97 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.481 0.658 . . . . 0.0 110.769 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.323 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -39.36 91.91 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 121.15 1.233 . . . . 0.0 111.687 -175.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.93 -37.98 69.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.959 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.13 -41.97 80.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.03 0.443 . . . . 0.0 110.129 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.6 t -55.22 -43.23 69.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.153 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.41 -52.17 54.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.61 67.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 0.0 111.172 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.1 ttt85 -72.19 -53.45 12.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.604 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -56.74 -31.56 64.67 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.756 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -76.84 -13.11 60.04 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 32.9 m -83.36 107.63 10.49 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.194 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.69 -15.8 22.33 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 121.215 1.277 . . . . 0.0 113.543 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.76 77.24 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.883 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 75.2 mt -99.88 141.59 16.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 117.615 0.707 . . . . 0.0 110.34 -176.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.453 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.15 156.13 26.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.753 -176.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.5 p -141.71 137.79 31.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.478 176.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 90.1 p -123.9 163.44 35.3 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.365 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -45.99 -46.0 16.66 Favored 'Trans proline' 0 N--CA 1.498 1.775 0 C-N-CA 121.424 1.416 . . . . 0.0 112.442 178.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -58.15 -43.06 87.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.363 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.3 m -60.08 -42.12 93.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.885 0.374 . . . . 0.0 110.601 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -58.02 -44.64 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.332 -178.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.85 -45.97 88.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.151 0.5 . . . . 0.0 110.252 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.568 HD22 HD12 ' A' ' 129' ' ' LEU . 36.4 mt -58.84 -41.46 86.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.585 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.537 ' CE2' HD11 ' A' ' 160' ' ' LEU . 45.5 t80 -58.62 -46.29 87.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.128 0.49 . . . . 0.0 110.351 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.0 ttp -57.6 -45.18 85.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.41 -45.64 87.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.45 92.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.461 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.537 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.6 mt -56.69 -43.33 80.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.581 -178.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.75 -46.53 88.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.278 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -56.62 -40.36 75.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.187 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 42.3 pt -88.4 14.0 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.05 14.67 82.38 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 121.415 -0.421 . . . . 0.0 113.592 173.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 61.7 mtt85 . . . . . 0 C--N 1.333 -0.151 0 CA-C-N 117.831 0.816 . . . . 0.0 110.334 177.532 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.5 mtp . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.921 0.391 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.0 mt -56.54 -44.87 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.796 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -49.08 78.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.407 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.3 m -54.01 -53.02 58.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 0.0 111.244 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.2 mmt-85 -56.73 -44.38 81.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.005 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -60.55 -40.35 91.25 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.693 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -58.3 -43.95 88.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 110.373 -178.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -60.76 -47.71 85.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.56 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.35 88.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.642 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.96 -42.0 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.861 -178.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.9 ttmp? -59.65 -46.93 87.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.063 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -124.93 109.98 13.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.451 178.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.8 -11.91 26.14 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 178.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.41 14.99 13.14 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.57 94.85 17.43 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.248 178.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -49.0 -34.69 29.98 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.341 1.361 . . . . 0.0 112.867 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -57.55 -55.38 35.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.84 0.352 . . . . 0.0 110.701 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.09 81.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.577 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.415 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.5 mm-40 -59.75 -46.37 89.37 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.684 -179.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.65 -46.77 74.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.918 0.389 . . . . 0.0 110.519 -176.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.22 -44.61 92.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.261 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -59.25 -44.71 92.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.978 0.418 . . . . 0.0 110.808 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.441 ' CB ' HD13 ' A' ' 155' ' ' LEU . 62.5 m-85 -57.66 -46.68 83.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.286 0.565 . . . . 0.0 110.141 -178.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 34.9 mttp -58.45 -46.73 85.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.54 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.18 -44.01 87.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.603 -177.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.2 -41.3 96.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.988 -177.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.468 HD11 ' O ' ' A' ' 155' ' ' LEU . 23.2 mt -64.29 -46.11 85.08 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.645 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -59.39 -40.15 85.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.094 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.8 m -84.17 15.0 3.75 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 -176.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 62.6 50.52 3.49 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.475 0.655 . . . . 0.0 110.76 177.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -124.93 49.6 3.4 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.177 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.521 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.3 Cg_endo -56.46 -40.53 83.98 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.17 1.247 . . . . 0.0 111.541 -175.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.13 -38.1 67.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.11 -179.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -68.28 -42.29 79.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.015 0.435 . . . . 0.0 110.021 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.61 -42.98 71.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.177 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 49.9 t -65.4 -51.92 58.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.572 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.5 t -54.73 -38.91 67.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.377 . . . . 0.0 111.258 -176.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -72.13 -53.07 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.539 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.69 -31.59 64.6 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -76.83 -14.52 59.9 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -81.83 107.81 9.42 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.789 -0.624 . . . . 0.0 110.232 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -57.98 -17.14 29.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 121.235 1.29 . . . . 0.0 113.51 -174.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.35 77.07 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.323 -0.465 . . . . 0.0 113.0 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.47 139.83 20.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 117.557 0.679 . . . . 0.0 110.389 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.415 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.31 156.05 16.51 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.633 0.73 . . . . 0.0 111.712 -176.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -144.21 137.83 27.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.457 176.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.3 p -126.0 163.49 39.27 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.42 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -46.04 -45.31 17.95 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.428 1.419 . . . . 0.0 112.477 178.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.23 -43.83 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.34 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.2 m -59.22 -41.61 89.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.498 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.02 -44.94 87.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.003 0.43 . . . . 0.0 110.445 -178.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.6 -45.42 89.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.164 0.507 . . . . 0.0 110.308 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.468 ' O ' HD11 ' A' ' 129' ' ' LEU . 41.7 mt -59.22 -42.21 90.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.477 -179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.548 ' CE2' HD11 ' A' ' 160' ' ' LEU . 50.0 t80 -58.05 -45.12 87.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.201 0.524 . . . . 0.0 110.327 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.99 -46.08 85.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.393 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.24 -45.21 88.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.508 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.54 92.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.075 0.464 . . . . 0.0 110.37 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.548 HD11 ' CE2' ' A' ' 156' ' ' TYR . 94.1 mt -56.17 -42.72 77.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.605 -178.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -59.83 -46.35 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.262 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -55.88 -41.57 74.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.156 -177.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.521 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.4 pt -88.77 14.06 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.35 20.57 79.92 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 121.38 -0.438 . . . . 0.0 113.31 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 117.637 0.719 . . . . 0.0 110.258 176.712 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.6 ttm . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.913 0.387 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.8 mt -55.8 -48.57 75.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.855 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -49.02 79.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -176.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.15 -53.24 53.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.009 0.433 . . . . 0.0 111.439 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -56.91 -44.52 82.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.978 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.53 -40.43 87.15 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.507 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -58.32 -45.09 88.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.873 0.368 . . . . 0.0 110.33 -178.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.36 -47.27 86.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.504 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.3 -44.59 92.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.69 -179.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -59.61 -43.2 93.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.863 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -59.3 -46.84 87.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.026 0.441 . . . . 0.0 110.029 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -124.06 108.76 12.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.386 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.43 -11.86 26.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.9 p -92.33 14.99 14.82 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 26.2 t -108.4 94.84 14.39 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 122.033 -0.417 . . . . 0.0 110.326 178.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -48.87 -34.89 29.77 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 121.345 1.363 . . . . 0.0 113.028 -175.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.94 -55.05 39.93 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.653 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.91 84.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.561 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.403 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.7 mm-40 -59.8 -45.52 92.08 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.678 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.57 75.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.969 0.414 . . . . 0.0 110.432 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.38 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.322 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.99 -44.9 91.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.788 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -57.8 -47.46 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -57.97 -46.27 85.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.0 mt -58.58 -44.32 89.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.562 -177.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.4 HD22 ' HB2' ' A' ' 136' ' ' TYR . 19.0 mt -60.34 -40.82 92.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.876 -177.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.86 -46.03 83.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.796 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.85 -39.74 82.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.974 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.3 m -85.33 15.15 4.56 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 62.48 50.43 3.65 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 121.459 0.647 . . . . 0.0 110.848 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.395 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.553 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.8 Cg_endo -56.14 -39.18 92.87 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.305 1.337 . . . . 0.0 111.523 -176.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.63 -38.26 69.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.06 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.4 ' HB2' HD22 ' A' ' 128' ' ' LEU . 17.3 m-85 -67.97 -42.83 80.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.019 0.438 . . . . 0.0 110.024 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.37 -42.09 65.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 55.7 t -65.84 -53.1 41.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.536 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 25.4 m -54.46 -38.04 65.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 111.24 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -72.98 -54.03 9.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.604 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -57.3 -30.3 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.784 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -76.96 -13.99 59.9 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.9 m -84.85 107.12 10.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.78 -0.628 . . . . 0.0 110.325 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -58.39 -15.18 23.28 Favored 'Trans proline' 0 N--CA 1.502 1.973 0 C-N-CA 121.219 1.28 . . . . 0.0 113.612 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.03 77.25 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.896 -177.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.4 mt -98.65 140.18 18.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 117.49 0.645 . . . . 0.0 110.355 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.403 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.64 156.14 20.72 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.544 0.688 . . . . 0.0 111.701 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.0 p -147.15 137.93 23.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.33 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -123.77 165.07 25.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.422 178.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.87 -43.96 18.92 Favored 'Trans proline' 0 N--CA 1.498 1.768 0 C-N-CA 121.434 1.423 . . . . 0.0 112.516 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.81 -45.94 88.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.257 177.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 72.1 m -58.0 -40.91 81.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.959 0.409 . . . . 0.0 110.513 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.52 -45.96 87.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.986 0.422 . . . . 0.0 110.456 -177.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -58.57 -44.37 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.255 0.55 . . . . 0.0 110.171 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.86 -42.15 83.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.54 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.421 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 20.9 t80 -58.97 -46.95 86.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.344 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.27 -43.2 82.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.448 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -59.32 -49.64 77.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.317 -178.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.21 -40.93 82.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.443 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.421 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 92.4 mt -56.93 -43.8 81.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.916 0.389 . . . . 0.0 110.444 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.64 -44.6 93.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.198 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 53.7 mtt-85 -55.58 -42.87 75.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.196 -176.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.553 HG23 ' HB2' ' A' ' 134' ' ' PRO . 26.1 pt -90.1 14.08 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.82 26.25 69.74 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 121.272 -0.49 . . . . 0.0 112.985 174.071 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 117.315 0.557 . . . . 0.0 109.952 175.3 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.672 0.273 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 127' ' ' LEU . 26.7 mt -53.88 -52.19 61.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.036 0.446 . . . . 0.0 111.077 -178.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.33 -48.98 75.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.58 -175.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.2 m -53.08 -54.05 41.32 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.703 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.543 ' HD2' HD11 ' A' ' 127' ' ' LEU . 81.5 mtt-85 -63.57 -37.74 88.45 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.846 -177.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -60.51 -39.93 89.59 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.485 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -59.06 -46.5 88.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.871 0.367 . . . . 0.0 110.182 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.08 -45.7 92.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.519 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.76 -46.01 90.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.676 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -58.93 -43.1 91.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.898 -177.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.63 -47.2 87.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.941 0.4 . . . . 0.0 110.115 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -120.02 105.58 11.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.316 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -92.29 -12.01 33.64 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.96 15.04 14.02 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.7 t -107.75 94.66 12.69 Favored Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 118.046 0.385 . . . . 0.0 110.296 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.89 -39.68 39.72 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.44 1.427 . . . . 0.0 113.162 -175.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -56.52 -51.31 69.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.826 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.57 -42.78 93.25 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.511 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -59.1 -45.39 90.99 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.783 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.72 -47.11 74.16 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.934 0.397 . . . . 0.0 110.527 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.1 92.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.278 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -59.83 -44.85 93.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.493 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.3 m-85 -57.4 -46.41 83.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 110.086 -178.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -58.78 -45.86 88.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.748 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.543 HD11 ' HD2' ' A' ' 107' ' ' ARG . 16.6 mt -58.2 -44.82 88.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 -178.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.6 mt -60.61 -40.68 92.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.932 -176.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.465 HD12 HD22 ' A' ' 155' ' ' LEU . 16.1 mt -64.66 -46.22 83.43 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.684 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.45 -39.48 83.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.071 -177.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.8 m -86.01 16.62 4.06 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 62.36 50.57 3.71 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.495 0.665 . . . . 0.0 110.857 176.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.9 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.21 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.492 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.7 Cg_endo -57.23 -40.86 79.34 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.233 1.289 . . . . 0.0 111.629 -174.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.55 -37.79 68.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.037 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.22 -42.78 79.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.078 -178.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.43 -42.89 69.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.122 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.8 t -65.52 -52.19 54.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.572 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 m -54.91 -38.85 68.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.238 -176.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.04 -53.28 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.52 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.74 -32.6 65.72 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.011 -0.276 . . . . 0.0 111.661 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.83 -12.36 59.96 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.399 0.889 . . . . 0.0 113.399 -177.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.0 m -83.72 107.63 10.9 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.146 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -57.66 -16.67 25.56 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.185 1.256 . . . . 0.0 113.489 -174.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.25 76.97 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.962 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -100.21 140.96 18.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.597 0.698 . . . . 0.0 110.342 -176.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.66 156.11 20.83 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.629 0.728 . . . . 0.0 111.741 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.52 137.91 30.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.426 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 93.7 p -124.55 163.31 37.43 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.384 177.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -45.96 -45.01 18.12 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.483 1.455 . . . . 0.0 112.458 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.33 -43.24 88.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.378 177.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . 0.401 ' HA ' HD12 ' A' ' 155' ' ' LEU . 75.8 m -59.75 -41.62 91.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.989 0.423 . . . . 0.0 110.572 -179.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.12 -45.77 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.039 0.447 . . . . 0.0 110.432 -178.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.97 -45.54 90.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.203 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.493 HD13 ' CB ' ' A' ' 125' ' ' TYR . 44.8 mt -58.22 -41.38 83.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.555 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.9 t80 -59.36 -47.37 85.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.203 0.525 . . . . 0.0 110.467 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.72 -44.5 86.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.49 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.41 -45.97 90.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.09 -44.09 91.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.947 0.404 . . . . 0.0 110.32 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.555 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.4 mt -56.4 -43.29 79.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.681 -178.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.68 -46.36 89.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 8.7 mtp-105 -56.88 -40.92 77.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.271 -177.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.492 HG23 ' HB2' ' A' ' 134' ' ' PRO . 39.0 pt -87.57 14.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -175.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.61 20.25 79.79 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 119.859 -0.412 . . . . 0.0 113.331 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 117.734 0.767 . . . . 0.0 110.011 176.699 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.3 ttm . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.931 0.396 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.81 -46.39 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.93 79.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.392 -176.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.4 -52.83 58.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.019 0.438 . . . . 0.0 111.397 -178.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -56.71 -45.66 81.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.059 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -60.25 -39.38 86.57 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.705 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . 0.4 ' HG2' ' HZ2' ' A' ' 113' ' ' LYS . 38.7 tt0 -57.74 -44.36 85.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.337 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -61.04 -48.66 80.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.496 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.57 -42.81 88.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.686 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -59.11 -43.39 91.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 -178.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.4 ' HZ2' ' HG2' ' A' ' 109' ' ' GLN . 37.4 mttp -58.91 -46.94 86.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.117 0.484 . . . . 0.0 110.076 179.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -125.93 108.8 11.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.473 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.39 -11.96 26.81 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 177.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.61 14.73 14.23 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.1 t -107.87 94.82 13.23 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.066 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -48.78 -34.77 28.81 Favored 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.396 1.397 . . . . 0.0 113.114 -174.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.76 -55.41 35.18 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.652 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.67 85.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.555 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -59.28 -45.56 90.92 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.772 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.74 -49.19 71.42 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.461 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.75 89.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.37 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . 0.421 ' HA ' HD12 ' A' ' 127' ' ' LEU . 17.1 t80 -59.28 -44.36 92.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.483 ' CB ' HD13 ' A' ' 155' ' ' LEU . 58.4 m-85 -56.76 -43.98 81.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.349 0.595 . . . . 0.0 110.178 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -58.19 -48.21 81.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.938 -178.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 124' ' ' PHE . 44.3 mt -57.0 -43.88 82.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.612 -176.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.413 HD22 ' HB2' ' A' ' 136' ' ' TYR . 22.3 mt -61.22 -41.02 96.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.956 -177.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.454 HD12 HD22 ' A' ' 155' ' ' LEU . 14.0 mt -64.53 -46.05 84.56 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.511 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.72 -40.49 83.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.9 m -85.44 15.98 4.09 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 m120 61.8 51.18 3.94 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.506 0.669 . . . . 0.0 110.718 177.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -124.87 49.88 3.59 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.149 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.44 -39.81 88.8 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.108 1.205 . . . . 0.0 111.58 -175.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.92 -38.15 69.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.994 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . 0.413 ' HB2' HD22 ' A' ' 128' ' ' LEU . 4.1 m-85 -68.18 -42.54 79.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.04 0.448 . . . . 0.0 110.086 -178.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.75 -42.86 71.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.151 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.71 -52.12 54.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.647 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -55.06 -38.69 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.82 0.343 . . . . 0.0 111.115 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.03 -53.01 14.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.495 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.61 -32.51 65.34 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.726 -176.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -76.98 -12.18 59.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -177.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.7 m -84.01 107.87 12.06 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.226 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -57.62 -16.3 23.84 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 121.263 1.309 . . . . 0.0 113.542 -174.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -22.66 77.19 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 121.228 -0.51 . . . . 0.0 112.902 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.5 mt -100.89 140.32 20.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.574 0.687 . . . . 0.0 110.281 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.21 156.16 22.68 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.69 0.757 . . . . 0.0 111.578 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.5 p -143.03 137.81 29.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.411 175.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -126.1 165.09 29.55 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.463 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.88 -44.12 18.8 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 121.486 1.457 . . . . 0.0 112.424 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.6 -45.35 89.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.903 0.382 . . . . 0.0 110.288 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.4 m -58.78 -41.01 85.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.56 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.18 -45.47 87.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.435 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -59.1 -46.36 88.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.483 HD13 ' CB ' ' A' ' 125' ' ' TYR . 46.5 mt -58.1 -42.25 85.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.519 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.543 ' CE2' HD11 ' A' ' 160' ' ' LEU . 46.8 t80 -59.91 -45.99 90.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.659 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.4 ttp -57.72 -45.44 85.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.411 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -58.73 -46.0 88.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.41 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.19 90.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.09 0.472 . . . . 0.0 110.364 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.543 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.9 mt -56.58 -44.19 80.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.655 -178.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -58.95 -46.11 88.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.4 mtp180 -56.62 -41.02 76.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.226 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -89.23 14.05 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -175.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.63 19.78 79.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 121.342 -0.456 . . . . 0.0 113.399 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 117.598 0.699 . . . . 0.0 110.192 176.883 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.6 mtp . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.871 0.367 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.1 mt -56.04 -47.34 78.06 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.956 -178.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.18 78.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.386 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.88 -52.43 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 111.243 -178.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -56.76 -45.7 81.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.62 -40.06 86.31 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.556 -178.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.33 -45.66 87.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.882 0.372 . . . . 0.0 110.401 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -60.25 -46.18 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.453 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.67 84.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.659 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.48 -40.51 87.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.939 -177.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.36 -46.8 87.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.052 0.453 . . . . 0.0 109.976 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -125.48 108.08 11.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.3 177.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.9 mt -93.39 -11.81 31.36 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.43 14.96 15.1 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -108.36 94.82 14.26 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 118.057 0.39 . . . . 0.0 110.291 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -48.83 -34.45 28.18 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 121.417 1.411 . . . . 0.0 113.105 -175.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -58.32 -55.2 38.06 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.629 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.78 -41.67 82.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.641 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.402 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.4 mm-40 -59.8 -46.38 89.4 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.419 -0.512 . . . . 0.0 109.658 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.66 -45.52 73.87 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.98 0.419 . . . . 0.0 110.531 -175.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.49 92.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.204 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -58.99 -44.26 91.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.001 0.429 . . . . 0.0 110.8 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.499 ' CB ' HD13 ' A' ' 155' ' ' LEU . 60.7 m-85 -57.47 -46.79 83.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 0.0 110.063 -178.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -58.19 -46.65 85.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.521 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.28 -43.76 88.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 -177.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.3 mt -61.45 -41.05 96.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.983 -176.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.454 HD11 ' O ' ' A' ' 155' ' ' LEU . 19.6 mt -64.92 -46.03 83.35 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.716 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.4 -39.76 84.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.133 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.5 m -85.27 16.32 3.72 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -176.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 62.16 50.66 3.85 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.488 0.661 . . . . 0.0 110.731 176.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -124.89 49.57 3.35 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.375 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.486 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.2 Cg_endo -57.04 -40.43 83.87 Favored 'Trans proline' 0 N--CA 1.497 1.687 0 C-N-CA 121.168 1.245 . . . . 0.0 111.691 -175.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.66 -37.41 68.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.024 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.81 -42.1 77.74 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.974 0.416 . . . . 0.0 110.135 -178.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.13 -41.82 61.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.269 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 62.0 t -65.26 -53.23 42.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.514 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 m -54.45 -38.42 66.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 111.238 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.2 ttt85 -73.08 -53.27 11.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.535 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -57.37 -30.33 64.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.733 -176.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.79 -12.79 60.03 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.4 m -85.66 106.98 10.81 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.69 -0.671 . . . . 0.0 110.241 179.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.43 -14.17 19.58 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.209 1.273 . . . . 0.0 113.613 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.76 76.83 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.772 -177.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -98.37 140.73 17.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 117.53 0.665 . . . . 0.0 110.377 -176.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.402 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -62.08 156.06 22.47 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.619 0.723 . . . . 0.0 111.719 -177.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -144.88 137.86 26.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.505 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.06 165.06 29.66 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.386 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.93 -44.63 18.43 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.476 1.451 . . . . 0.0 112.476 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.34 -44.8 88.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.948 0.404 . . . . 0.0 110.3 177.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . 0.421 ' HA ' HD12 ' A' ' 155' ' ' LEU . 74.9 m -58.79 -42.15 88.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.476 -179.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.1 mtp -58.82 -45.09 90.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.546 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -58.56 -45.48 88.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.206 0.526 . . . . 0.0 110.19 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.499 HD13 ' CB ' ' A' ' 125' ' ' TYR . 35.1 mt -58.16 -43.19 87.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.284 0.564 . . . . 0.0 110.288 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.405 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.4 t80 -57.9 -45.31 86.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.362 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -57.72 -45.16 86.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.456 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.63 -46.12 87.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.463 -178.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.64 91.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.405 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 93.3 mt -56.36 -43.58 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.581 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -59.71 -46.1 90.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.239 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -56.34 -40.89 75.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.222 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.486 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.8 pt -88.28 13.99 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -174.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.58 19.79 78.93 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.382 -0.437 . . . . 0.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . 0.405 ' HD2' HD11 ' A' ' 163' ' ' ILE . 94.3 mtt180 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 117.645 0.723 . . . . 0.0 110.124 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.8 mtp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.948 0.404 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.5 mt -55.57 -47.16 76.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.009 -178.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.69 -49.06 79.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.529 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.6 m -54.08 -52.69 60.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.871 0.367 . . . . 0.0 111.265 -178.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 33.6 mmt180 -57.28 -45.16 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.885 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -59.87 -40.2 87.82 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.548 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -58.61 -45.58 88.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.817 0.341 . . . . 0.0 110.308 -178.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.35 -46.18 90.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.536 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.62 -48.05 83.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.5 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.27 -40.77 87.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.95 -177.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.4 tttp -59.29 -46.28 88.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.081 0.467 . . . . 0.0 110.008 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -126.11 108.66 11.55 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.317 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -93.47 -11.94 30.87 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.31 15.01 14.73 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 17.7 t -108.51 94.72 14.39 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.255 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -48.73 -34.95 28.97 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 121.379 1.386 . . . . 0.0 113.067 -175.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.77 -55.06 39.74 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.634 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.65 83.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.638 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -59.47 -45.9 90.32 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.74 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.46 -47.2 73.19 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.127 0.489 . . . . 0.0 110.424 -176.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -45.07 92.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.265 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -58.64 -44.27 90.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.808 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.474 ' CB ' HD13 ' A' ' 155' ' ' LEU . 61.7 m-85 -57.58 -46.75 83.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.272 0.558 . . . . 0.0 110.103 -178.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 29.9 mttp -58.51 -45.93 87.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.683 -178.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.47 -44.37 89.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.529 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.87 -41.28 95.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.994 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.492 HD11 ' O ' ' A' ' 155' ' ' LEU . 23.2 mt -64.68 -46.14 83.67 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.714 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.94 -40.02 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.071 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 68.1 m -85.75 16.57 3.91 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 61.76 51.06 4.02 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.42 0.628 . . . . 0.0 110.697 176.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -124.86 49.6 3.36 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.272 177.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.548 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.8 Cg_endo -56.19 -40.65 83.47 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.225 1.283 . . . . 0.0 111.579 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.46 -38.03 68.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.09 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.63 -41.78 78.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 110.188 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.3 t -55.44 -42.39 67.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.235 179.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 52.6 t -65.96 -52.49 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.7 m -54.63 -38.33 66.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.801 0.334 . . . . 0.0 111.212 -176.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -73.06 -53.35 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.516 -178.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -56.78 -31.58 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.91 -12.91 60.02 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.5 m -84.69 107.45 11.38 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-O 118.73 -0.653 . . . . 0.0 110.24 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.83 -15.83 23.19 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 121.238 1.292 . . . . 0.0 113.554 -174.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.08 -22.16 77.18 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.868 -177.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -100.24 139.44 21.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 117.646 0.723 . . . . 0.0 110.266 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.09 156.07 18.94 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.571 0.701 . . . . 0.0 111.861 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.7 p -144.77 137.89 26.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.394 176.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -126.03 164.99 30.02 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.547 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.86 -44.84 17.94 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.506 1.471 . . . . 0.0 112.533 179.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.29 -44.03 88.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.981 0.419 . . . . 0.0 110.376 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.7 m -59.17 -41.76 89.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.489 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.33 -45.67 87.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.412 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.53 -45.4 88.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.127 0.489 . . . . 0.0 110.238 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.492 ' O ' HD11 ' A' ' 129' ' ' LEU . 45.0 mt -58.41 -42.67 87.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.347 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -58.12 -45.69 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.124 0.488 . . . . 0.0 110.354 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.06 -44.35 82.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.497 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -58.99 -49.06 79.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.229 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.56 83.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.566 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.81 -43.23 80.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.958 0.408 . . . . 0.0 110.403 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.89 -44.71 94.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.281 177.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -55.48 -43.09 75.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.068 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.548 HG23 ' HB2' ' A' ' 134' ' ' PRO . 31.4 pt -89.24 14.14 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -174.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.93 25.59 68.92 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 121.238 -0.506 . . . . 0.0 113.116 173.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . 0.45 ' NE ' HD12 ' A' ' 163' ' ' ILE . 88.3 mtt180 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 117.353 0.577 . . . . 0.0 110.05 175.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.873 0.368 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.53 -46.48 80.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.3 -49.02 79.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.296 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.67 -53.33 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.357 -178.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -56.72 -43.75 80.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.26 -40.44 90.33 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.61 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -57.99 -43.76 86.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.898 0.38 . . . . 0.0 110.398 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -60.59 -47.81 84.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.482 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.85 90.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.671 -178.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.26 -42.32 90.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.863 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.0 tttp -58.95 -46.02 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.06 0.457 . . . . 0.0 110.036 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -127.68 110.39 12.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.381 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.8 mt -95.3 -11.91 27.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.08 15.01 14.3 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.9 t -108.67 94.87 15.02 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 119.195 -0.431 . . . . 0.0 110.295 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.77 -34.4 27.65 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.402 1.401 . . . . 0.0 113.038 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.79 -55.67 31.89 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.683 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.7 83.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.579 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.408 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 41.9 mm-40 -59.68 -45.8 90.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.739 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.64 75.08 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.963 0.411 . . . . 0.0 110.481 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.39 -44.55 92.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.285 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.04 -44.87 91.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.025 0.44 . . . . 0.0 110.926 -178.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.48 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.6 m-85 -57.7 -46.66 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.341 0.591 . . . . 0.0 110.099 -178.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.7 mttp -58.48 -45.96 87.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.4 mt -58.21 -44.38 88.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 -178.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 20.0 mt -60.86 -40.88 94.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.924 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.466 HD12 HD22 ' A' ' 155' ' ' LEU . 15.2 mt -64.42 -46.1 84.69 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.67 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -58.92 -39.93 83.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.746 0.308 . . . . 0.0 111.08 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.7 m -85.05 14.91 4.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -176.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.8 t30 62.53 50.56 3.55 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.499 0.666 . . . . 0.0 110.808 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.204 177.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.514 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.9 Cg_endo -56.96 -39.12 93.77 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 121.159 1.239 . . . . 0.0 111.605 -175.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -55.88 -38.07 69.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.05 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -68.41 -42.18 79.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.938 0.399 . . . . 0.0 110.059 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.5 t -55.77 -42.89 71.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.187 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.9 t -65.83 -51.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.617 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.1 t -54.84 -38.7 67.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.931 0.396 . . . . 0.0 111.183 -176.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -72.42 -53.12 13.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.551 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -56.55 -32.15 64.85 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.683 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.88 -11.91 59.89 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -85.28 107.22 11.24 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.292 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.98 -15.22 21.47 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 121.298 1.332 . . . . 0.0 113.502 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.88 77.28 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 121.279 -0.486 . . . . 0.0 112.858 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.3 mt -99.83 141.14 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.514 0.657 . . . . 0.0 110.282 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.408 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.58 156.07 20.65 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.624 0.726 . . . . 0.0 111.689 -176.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -142.8 137.91 30.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.454 176.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 96.7 p -125.97 163.34 40.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.406 177.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.13 -45.22 18.43 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 121.459 1.439 . . . . 0.0 112.454 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.44 -43.48 88.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.251 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.1 m -59.69 -41.36 90.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.562 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.1 -45.16 87.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.999 0.428 . . . . 0.0 110.429 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.81 -45.27 90.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.224 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.48 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.7 mt -58.97 -41.77 88.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.562 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.534 ' CE2' HD11 ' A' ' 160' ' ' LEU . 49.4 t80 -58.8 -45.99 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.184 0.516 . . . . 0.0 110.347 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 64.1 ttp -57.68 -46.01 84.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.39 -179.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.41 -45.23 88.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.503 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.4 -44.49 92.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.436 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.534 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.4 mt -56.09 -42.31 76.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.694 -178.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -60.24 -46.17 90.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.231 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.3 mtp85 -56.43 -41.39 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.216 -177.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.514 HG23 ' HB2' ' A' ' 134' ' ' PRO . 37.2 pt -88.18 14.02 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -175.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.36 24.67 74.95 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 121.498 -0.382 . . . . 0.0 113.06 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 45.1 mtp85 . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 117.485 0.642 . . . . 0.0 110.056 176.238 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.5 mtp . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.773 0.32 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 127' ' ' LEU . 13.7 mt -53.53 -52.11 60.72 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.116 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.46 -49.01 73.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.716 -174.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -54.17 -54.08 44.7 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.583 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.599 ' HD2' HD11 ' A' ' 127' ' ' LEU . 77.8 mtt-85 -63.93 -37.05 85.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.942 -177.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -61.26 -40.14 92.97 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.468 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -59.31 -45.58 90.92 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.19 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -59.95 -45.2 93.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.542 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.32 -47.7 84.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.62 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -58.96 -41.55 87.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.969 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -59.76 -47.16 86.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.073 0.464 . . . . 0.0 110.024 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -125.74 111.12 14.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.366 177.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.7 mt -94.64 -11.99 28.24 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -91.71 15.06 13.52 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.3 t -107.81 94.89 13.23 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.295 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -48.92 -37.22 36.28 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.363 1.375 . . . . 0.0 113.113 -174.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.27 -53.79 54.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 0.0 110.675 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.19 -42.68 86.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.598 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.46 -45.15 92.44 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.77 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -47.08 73.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.937 0.398 . . . . 0.0 110.477 -176.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.02 -44.54 91.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.338 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.71 -43.66 94.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.433 . . . . 0.0 110.863 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.473 ' CB ' HD13 ' A' ' 155' ' ' LEU . 62.6 m-85 -57.64 -46.49 84.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.321 0.581 . . . . 0.0 110.018 -179.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.9 mttt -58.89 -42.95 90.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.758 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.599 HD11 ' HD2' ' A' ' 107' ' ' ARG . 14.1 mt -58.26 -48.15 81.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.0 110.35 -179.317 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.39 -40.19 85.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.592 HD12 HD22 ' A' ' 155' ' ' LEU . 23.9 mt -65.37 -46.13 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.832 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -59.02 -39.14 81.0 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.969 -177.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.1 m -87.61 17.34 4.71 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.2 t30 62.15 50.56 3.91 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.431 0.634 . . . . 0.0 110.883 176.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.86 49.45 3.23 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.544 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.34 -39.69 89.65 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 121.236 1.291 . . . . 0.0 111.707 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.36 -38.46 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.016 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -67.98 -41.97 81.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.412 . . . . 0.0 110.126 -178.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.95 -43.53 75.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.185 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.2 t -65.1 -51.99 58.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.539 -177.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -55.29 -39.41 69.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.945 0.403 . . . . 0.0 111.135 -176.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -71.66 -51.7 21.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.573 -178.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -57.14 -33.06 67.0 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.649 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -76.96 -10.2 59.21 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.6 m -84.2 107.54 11.17 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.708 -0.663 . . . . 0.0 110.223 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.74 -17.39 29.12 Favored 'Trans proline' 0 N--CA 1.501 1.956 0 C-N-CA 121.237 1.291 . . . . 0.0 113.478 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.91 -21.65 76.8 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.01 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.2 mt -101.08 140.3 20.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 117.58 0.69 . . . . 0.0 110.355 -176.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.61 156.11 24.19 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.767 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -142.8 137.85 29.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.381 176.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.5 p -125.96 165.11 29.17 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.457 177.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.96 -44.58 18.63 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 121.416 1.411 . . . . 0.0 112.482 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.51 -44.36 89.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.273 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.43 -41.91 90.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.401 . . . . 0.0 110.523 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.15 -45.35 87.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.358 -177.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -58.8 -45.9 88.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.206 0.527 . . . . 0.0 110.235 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.592 HD22 HD12 ' A' ' 129' ' ' LEU . 34.5 mt -59.09 -41.33 87.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.556 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.569 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.2 t80 -58.16 -46.56 85.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.178 0.513 . . . . 0.0 110.149 179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.8 ttp -57.72 -43.99 85.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.496 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.78 -46.58 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.553 -178.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.36 91.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.007 0.432 . . . . 0.0 110.352 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.569 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.7 mt -56.78 -43.16 80.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.565 -178.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -46.15 89.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.178 179.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.6 mtp85 -56.19 -42.35 77.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.206 -176.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.428 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.7 pt -89.47 14.07 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.92 23.13 70.03 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.282 172.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . 0.428 ' NE ' HD12 ' A' ' 163' ' ' ILE . 88.3 mtt180 . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 117.516 0.658 . . . . 0.0 110.251 175.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.2 mmm . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.851 0.357 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.4 mt -56.2 -48.74 75.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.858 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.64 -49.04 79.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.289 -176.646 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.08 -53.49 49.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.39 -178.554 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.7 -44.74 81.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -178.825 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.14 -39.54 86.69 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.662 -179.18 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -58.06 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.94 0.4 . . . . 0.0 110.318 -178.774 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.4 -47.42 86.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.435 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.09 91.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.668 -178.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -59.35 -43.18 92.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.842 -178.371 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -59.11 -46.32 88.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.09 0.472 . . . . 0.0 110.095 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -125.72 108.88 11.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.33 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.16 -11.88 27.37 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 178.54 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.82 14.95 14.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.2 t -108.25 94.73 13.87 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.206 -0.426 . . . . 0.0 110.285 178.485 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -48.76 -34.53 27.98 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.411 1.407 . . . . 0.0 113.053 -175.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -58.03 -55.43 35.06 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.593 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.83 83.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.574 -179.042 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.41 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.1 mm-40 -59.81 -45.89 90.92 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.665 -178.924 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.53 74.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.003 0.43 . . . . 0.0 110.544 -176.297 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.82 92.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.307 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -59.17 -44.35 92.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.928 0.394 . . . . 0.0 110.834 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.489 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.7 m-85 -57.73 -46.61 84.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.132 -178.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -58.55 -45.93 87.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.676 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.3 -44.51 88.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.542 -178.039 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.6 mt -60.96 -41.06 95.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.859 -176.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.464 HD12 HD22 ' A' ' 155' ' ' LEU . 12.6 mt -63.93 -46.11 86.22 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.611 179.818 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.79 -40.56 84.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.029 -177.677 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -84.85 15.99 3.62 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 61.75 50.86 4.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.792 177.01 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.9 49.15 3.0 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.275 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.52 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.0 Cg_endo -57.51 -39.75 86.19 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 121.111 1.207 . . . . 0.0 111.765 -174.755 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.6 -37.94 68.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.0 -179.65 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.9 79.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.001 0.429 . . . . 0.0 110.176 -179.075 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.36 -42.72 68.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.247 179.249 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 44.8 t -65.57 -52.23 53.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.5 -177.618 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.1 m -54.87 -39.06 68.27 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.883 0.373 . . . . 0.0 111.191 -176.526 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -71.86 -52.72 16.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.592 -178.928 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.29 -32.91 65.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -176.228 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -76.81 -12.21 59.94 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.009 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 27.0 m -83.44 107.82 11.21 Favored Pre-proline 0 CA--C 1.535 0.385 0 CA-C-O 118.669 -0.681 . . . . 0.0 110.338 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.61 -16.62 25.05 Favored 'Trans proline' 0 N--CA 1.501 1.947 0 C-N-CA 121.249 1.299 . . . . 0.0 113.516 -174.689 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.03 -22.9 77.34 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.842 -177.1 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.9 140.77 18.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.567 0.683 . . . . 0.0 110.28 -176.305 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.41 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.51 156.05 20.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.569 0.699 . . . . 0.0 111.749 -176.99 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.0 p -142.23 137.89 31.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.405 176.53 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.9 p -126.02 163.23 40.95 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.522 177.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.08 -45.26 18.18 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.43 1.42 . . . . 0.0 112.472 178.728 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.33 -43.31 88.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.308 177.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.6 m -59.81 -41.51 91.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.554 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.07 -45.21 87.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.372 -178.28 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.73 -45.45 89.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.13 0.491 . . . . 0.0 110.207 179.725 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.489 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.3 mt -59.03 -40.94 86.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.712 -179.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.537 ' CE2' HD11 ' A' ' 160' ' ' LEU . 57.4 t80 -58.78 -47.24 85.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.127 0.489 . . . . 0.0 110.256 179.779 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.2 ttp -57.95 -44.8 87.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.42 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.45 -45.15 89.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.538 -178.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.54 93.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.049 0.452 . . . . 0.0 110.496 -178.241 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.537 HD11 ' CE2' ' A' ' 156' ' ' TYR . 92.2 mt -56.56 -41.96 77.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.589 -178.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -60.7 -45.78 92.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.445 178.687 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 -56.19 -41.03 74.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.178 -177.111 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.52 HG23 ' HB2' ' A' ' 134' ' ' PRO . 36.0 pt -86.48 14.03 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -175.517 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.54 20.0 79.77 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 121.502 -0.38 . . . . 0.0 113.182 174.504 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 117.696 0.748 . . . . 0.0 109.848 177.39 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 72.8 mtm . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.789 0.328 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.4 -48.01 75.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.96 -178.634 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.04 79.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.372 -176.343 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.33 -51.79 61.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.907 0.384 . . . . 0.0 111.344 -178.217 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -56.8 -46.11 81.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.002 -179.037 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -59.83 -40.01 87.04 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.582 -179.033 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.34 -45.78 87.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.323 -178.482 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -60.29 -46.66 89.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.563 -178.681 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.05 89.52 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 -179.511 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 56.2 t-20 -59.05 -43.41 91.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.026 -177.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -60.07 -47.31 86.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.951 0.405 . . . . 0.0 110.133 -179.481 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -121.92 108.85 13.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.383 178.151 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.4 mt -95.65 -11.88 26.47 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 178.429 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 80.0 p -92.36 15.07 14.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.152 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.9 t -109.09 94.79 15.84 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.208 178.249 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -48.87 -35.19 30.59 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.411 1.407 . . . . 0.0 112.92 -175.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -57.77 -54.93 41.33 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.667 -179.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.7 81.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.576 -179.02 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.413 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 44.8 mm-40 -59.82 -47.05 87.29 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.689 -179.191 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.43 -46.34 73.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.883 0.373 . . . . 0.0 110.583 -175.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.53 91.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.245 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -58.63 -44.57 90.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.854 -179.15 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.445 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.2 m-85 -57.71 -46.76 83.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.327 0.584 . . . . 0.0 110.114 -178.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -58.46 -46.41 86.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.678 -178.136 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 44.6 mt -58.67 -44.34 90.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.544 -178.088 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.4 mt -61.4 -40.68 95.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.946 -176.643 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.467 HD11 ' O ' ' A' ' 155' ' ' LEU . 18.6 mt -64.92 -46.14 82.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.655 179.879 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.45 -39.71 84.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.693 0.283 . . . . 0.0 111.101 -177.792 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.3 m -85.64 16.42 3.94 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -176.774 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 58.3 t30 62.18 50.85 3.75 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.464 0.65 . . . . 0.0 110.848 176.705 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.95 48.68 2.73 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.397 177.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.499 ' HB2' HG23 ' A' ' 163' ' ' ILE . 19.1 Cg_endo -57.3 -39.38 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.133 1.222 . . . . 0.0 111.694 -174.568 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.95 -38.18 69.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.021 -179.12 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -69.38 -41.61 76.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.905 0.383 . . . . 0.0 110.016 -179.047 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.6 t -55.34 -42.82 68.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.153 179.179 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -66.4 -52.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.646 -177.541 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 85.0 p -54.64 -37.7 65.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.832 0.349 . . . . 0.0 111.205 -176.666 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.92 -54.02 9.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.54 -179.077 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.64 -30.91 63.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.838 0.311 . . . . 0.0 111.838 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.81 -16.03 59.56 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.959 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 9.2 m -81.25 107.91 9.11 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.218 -179.7 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -57.62 -16.39 24.2 Favored 'Trans proline' 0 N--CA 1.502 1.994 0 C-N-CA 121.13 1.22 . . . . 0.0 113.501 -174.384 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -23.4 77.06 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 121.296 -0.478 . . . . 0.0 112.913 -177.074 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.23 140.73 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 117.51 0.655 . . . . 0.0 110.362 -176.076 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.413 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.48 156.05 20.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.637 0.732 . . . . 0.0 111.8 -176.95 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.1 p -144.15 137.89 27.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.418 176.237 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.2 p -125.55 163.53 38.17 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.259 177.671 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -45.97 -45.11 18.03 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 121.527 1.485 . . . . 0.0 112.456 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.34 -44.12 88.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.271 177.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.53 -41.23 89.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.545 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.04 -45.22 87.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.952 0.406 . . . . 0.0 110.427 -178.069 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -58.73 -45.79 88.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.138 0.494 . . . . 0.0 110.223 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.467 ' O ' HD11 ' A' ' 129' ' ' LEU . 41.6 mt -58.72 -41.64 86.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.536 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.535 ' CE2' HD11 ' A' ' 160' ' ' LEU . 45.5 t80 -58.63 -46.06 87.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.162 0.506 . . . . 0.0 110.375 179.661 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -58.08 -44.38 87.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.453 -178.995 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.74 -47.01 86.09 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.42 -177.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.72 90.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.063 0.458 . . . . 0.0 110.374 -178.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.535 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.7 mt -56.33 -43.47 79.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.594 -178.655 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.48 -46.47 88.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.228 179.715 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -56.73 -40.79 76.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.263 -176.896 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.499 HG23 ' HB2' ' A' ' 134' ' ' PRO . 41.0 pt -88.5 14.08 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.118 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.71 19.35 79.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.423 -0.418 . . . . 0.0 113.371 174.422 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . 0.402 ' HD2' HD11 ' A' ' 163' ' ' ILE . 93.2 mtt180 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 117.659 0.73 . . . . 0.0 110.17 176.78 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.919 0.39 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.43 -47.06 79.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.841 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.07 79.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.187 -176.63 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.54 -52.74 58.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.932 0.396 . . . . 0.0 111.341 -178.469 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.29 -44.94 80.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.078 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -59.81 -40.25 87.75 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.709 -178.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -58.27 -44.96 88.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.402 . . . . 0.0 110.346 -178.738 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -60.5 -46.19 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.571 -179.313 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.32 86.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.523 -179.218 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -59.27 -41.19 88.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.35 -46.93 87.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.054 0.454 . . . . 0.0 109.936 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -124.61 106.78 10.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.179 177.289 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -94.22 -11.86 29.43 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 178.947 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.06 14.97 14.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.557 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.02 94.84 15.75 Favored Pre-proline 0 CA--C 1.533 0.326 0 O-C-N 122.07 -0.394 . . . . 0.0 110.339 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.82 -32.8 23.39 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 121.362 1.374 . . . . 0.0 113.011 -175.279 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.23 -55.46 34.62 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.565 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.32 82.83 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.604 -179.257 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.416 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 41.3 mm-40 -59.86 -46.1 90.37 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.396 -0.522 . . . . 0.0 109.693 -179.032 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.9 -46.15 74.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 110.484 -176.174 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.87 92.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.264 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -59.11 -44.96 92.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.877 -179.192 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 125' ' ' TYR . . . . . 0.507 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.5 m-85 -57.72 -46.25 84.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.298 0.57 . . . . 0.0 110.09 -178.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -58.19 -47.04 84.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.57 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.2 mt -58.16 -43.4 87.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.527 -177.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.3 mt -61.07 -41.26 96.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.94 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.461 HD12 HD22 ' A' ' 155' ' ' LEU . 14.2 mt -64.59 -46.1 84.14 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.521 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -58.25 -40.82 82.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.014 -177.651 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.7 m -85.73 16.11 4.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.416 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 22.6 m120 61.63 51.63 3.92 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.474 0.654 . . . . 0.0 110.718 176.803 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -124.82 50.39 3.99 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.113 178.032 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 134' ' ' PRO . . . . . 0.516 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.7 Cg_endo -56.87 -40.47 83.96 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.184 1.256 . . . . 0.0 111.591 -175.614 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.7 -37.15 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.147 -179.667 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -69.04 -42.27 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.938 0.399 . . . . 0.0 110.154 -178.67 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 54.4 t -55.29 -41.88 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.249 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 57.9 t -65.7 -53.37 39.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.536 -178.481 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 84.7 p -54.37 -38.11 65.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.942 0.401 . . . . 0.0 111.283 -176.017 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.2 ttt85 -72.97 -53.65 10.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.599 -179.051 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.52 -29.35 64.26 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.028 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.89 -14.28 59.9 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.738 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.6 m -84.79 107.22 10.66 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.25 179.686 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.46 -14.53 21.03 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.208 1.272 . . . . 0.0 113.586 -174.384 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.92 -23.51 76.94 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.302 -0.475 . . . . 0.0 112.919 -177.633 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -98.35 139.97 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 117.483 0.642 . . . . 0.0 110.297 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.416 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.19 156.06 19.33 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.76 -176.746 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 66.4 p -141.84 137.95 31.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.356 176.56 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 78.0 p -125.95 163.5 39.08 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.447 177.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -46.24 -45.64 18.05 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 121.446 1.431 . . . . 0.0 112.262 178.33 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.22 -44.68 88.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.371 177.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 152' ' ' CYS . . . . . 0.405 ' HA ' HD12 ' A' ' 155' ' ' LEU . 59.1 m -59.24 -41.55 88.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.408 . . . . 0.0 110.585 -179.454 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.15 -45.18 87.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.434 -177.849 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.12 -45.65 90.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.153 0.501 . . . . 0.0 110.322 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . 0.507 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.0 mt -57.63 -42.89 84.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.425 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 156' ' ' TYR . . . . . 0.529 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.2 t80 -59.54 -47.41 85.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.292 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 157' ' ' MET . . . . . 0.48 ' HA ' HD12 ' A' ' 160' ' ' LEU . 61.3 ttp -56.95 -43.04 81.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.638 -177.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -60.08 -49.14 78.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -178.459 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.08 -41.29 83.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.0 0.429 . . . . 0.0 110.496 -177.883 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 160' ' ' LEU . . . . . 0.529 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 60.1 mt -57.05 -44.19 82.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.363 -179.077 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.55 -44.4 93.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.358 178.37 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -55.19 -42.0 72.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.122 -177.417 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 163' ' ' ILE . . . . . 0.516 HG23 ' HB2' ' A' ' 134' ' ' PRO . 37.3 pt -89.33 14.02 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.82 16.53 79.9 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.331 -0.462 . . . . 0.0 113.429 174.434 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 . . . . . 0 C--N 1.331 -0.201 0 CA-C-N 117.765 0.783 . . . . 0.0 110.047 176.896 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 44.0 ttm . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.344 -0.613 . . . . 8.1600000000000001 109.344 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.2 t -109.76 132.37 58.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.201 -0.454 . . . . 4.8200000000000003 110.021 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.95 156.67 33.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 3.29 110.552 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.2 t -97.82 137.92 24.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.166 -0.47 . . . . 2.3999999999999999 109.998 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 55.5 m -93.91 144.3 25.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.261 -0.427 . . . . 1.1799999999999999 110.825 -178.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -79.03 -22.03 46.04 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.983 -0.553 . . . . 3.3599999999999999 112.463 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.88 -34.17 71.34 Favored 'General case' 0 C--N 1.334 -0.107 0 O-C-N 122.336 -0.228 . . . . 0.47999999999999998 111.485 -177.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.3 mtp -55.26 -47.19 75.81 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.833 0.349 . . . . 1.55 110.939 -179.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.9 mt -56.15 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.48999999999999999 110.804 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.03 79.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.333 -0.394 . . . . 0.20000000000000001 111.295 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.5 m -53.5 -52.29 60.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.858 0.361 . . . . 0.20999999999999999 111.395 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -45.16 82.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.31 -0.404 . . . . 1.96 110.928 -179.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.11 -40.41 89.59 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.794 -0.362 . . . . 1.1499999999999999 110.67 -178.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.38 -44.56 88.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.342 . . . . 1.8100000000000001 110.32 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.24 -45.52 92.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.13 -0.486 . . . . 2.02 110.53 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.59 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 0.13 110.589 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.2 m120 -59.04 -41.34 87.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.186 -0.461 . . . . 1.8999999999999999 110.923 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -58.81 -45.62 89.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.178 0.513 . . . . 2.5800000000000001 110.062 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -127.24 106.65 9.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.569 -0.741 . . . . 1.1299999999999999 110.225 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.1 mt -93.72 -11.89 30.45 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.806 0.669 . . . . 0.14999999999999999 112.806 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -92.29 14.98 14.76 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.894 0.702 . . . . 0.16 112.894 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.4 t -109.11 94.83 15.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 119.197 -0.43 . . . . 0.20000000000000001 110.298 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -48.78 -31.69 20.17 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.422 1.414 . . . . 0.13 113.213 -174.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.72 -56.18 25.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.889 0.376 . . . . 2.02 110.591 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.86 -40.55 80.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.406 -0.361 . . . . 0.080000000000000002 110.536 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.457 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 38.8 mm-40 -59.77 -47.47 85.57 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.628 -0.508 . . . . 0.10000000000000001 109.628 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.16 73.6 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 0.10000000000000001 110.483 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.51 -45.48 91.59 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.869 -0.605 . . . . 0.089999999999999997 110.297 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -59.63 -43.5 93.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.462 -0.335 . . . . 0.10000000000000001 110.857 -178.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.498 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.2 m-85 -57.41 -46.23 83.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.377 0.608 . . . . 0.10000000000000001 110.088 -179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -46.15 88.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.717 -0.674 . . . . 1.6200000000000001 110.721 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.5 mt -58.11 -43.86 87.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.044 -0.525 . . . . 0.46000000000000002 110.578 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.5 mt -61.02 -41.6 96.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.11 110.973 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.471 HD12 HD22 ' A' ' 155' ' ' LEU . 15.1 mt -64.3 -46.07 85.19 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.495 -0.482 . . . . 0.17000000000000001 110.619 179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -58.98 -40.06 83.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.495 -0.32 . . . . 1.8200000000000001 111.021 -177.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.5 m -85.87 16.32 4.19 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.219 0.822 . . . . 0.13 113.219 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 62.04 50.79 3.9 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.496 0.665 . . . . 2.1000000000000001 110.752 176.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -124.92 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 115.954 -0.566 . . . . 0.14999999999999999 111.397 177.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -57.57 -39.42 88.54 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.142 1.228 . . . . 0.13 111.663 -175.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.99 -37.86 69.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.294 -0.412 . . . . 2.0800000000000001 110.987 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.0 -42.77 80.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.985 0.421 . . . . 0.27000000000000002 109.945 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.9 t -55.45 -41.62 63.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.523 . . . . 0.13 110.306 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . 0.504 HG11 ' NH1' ' A' ' 165' ' ' ARG . 61.5 t -66.83 -54.67 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 0.20999999999999999 110.679 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 89.9 p -54.84 -38.92 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.034 0.445 . . . . 1.23 111.259 -175.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 64.5 ttt-85 -73.04 -50.27 23.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 0.70999999999999996 111.75 -178.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -56.95 -33.23 66.83 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.947 -0.301 . . . . 0.20000000000000001 111.609 -176.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -76.86 -8.43 57.32 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.459 0.911 . . . . 1.6200000000000001 113.459 -177.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.2 m -84.41 107.26 10.41 Favored Pre-proline 0 CA--C 1.536 0.413 0 CA-C-O 118.714 -0.66 . . . . 0.20000000000000001 110.175 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.7 -15.23 20.05 Favored 'Trans proline' 0 N--CA 1.502 1.979 0 C-N-CA 121.242 1.295 . . . . 0.22 113.575 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.68 77.23 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 121.221 -0.514 . . . . 0.17999999999999999 112.953 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -99.4 142.0 15.8 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 CA-C-N 117.569 0.684 . . . . 0.14000000000000001 110.471 -176.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.457 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.74 156.13 28.07 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.65 -0.705 . . . . 0.13 111.725 -177.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 63.3 p -140.88 137.82 33.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.333 -0.849 . . . . 0.19 110.506 176.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.8 p -125.77 163.18 40.74 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.666 -0.697 . . . . 0.38 109.517 177.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -46.04 -45.83 17.1 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.542 1.495 . . . . 0.20999999999999999 112.331 178.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.29 -43.4 88.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 2.04 110.344 178.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.61 -41.62 90.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.939 0.4 . . . . 0.14000000000000001 110.551 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.18 -45.79 86.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.989 0.423 . . . . 0.20000000000000001 110.387 -178.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.73 -45.17 90.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.064 -0.517 . . . . 1.1100000000000001 110.288 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.498 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.2 mt -58.41 -43.06 88.45 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.246 0.546 . . . . 0.16 110.45 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -58.52 -45.25 89.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.039 -0.528 . . . . 0.26000000000000001 110.402 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.6 ttp -57.29 -45.03 84.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.03 -0.532 . . . . 0.52000000000000002 110.468 -178.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.33 -46.34 86.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.092 -0.504 . . . . 1.8500000000000001 110.448 -178.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.29 90.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.12 110.348 -178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.8 mt -56.38 -42.79 78.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 0.16 110.613 -178.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -58.76 -47.39 84.85 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 1.02 110.227 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -56.32 -41.68 76.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.874 -0.603 . . . . 1.8899999999999999 111.338 -176.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.6 pt -89.54 13.95 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 113.574 0.953 . . . . 0.16 113.574 -175.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 69.32 25.3 75.59 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 121.366 -0.445 . . . . 0.19 113.027 173.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.504 ' NH1' HG11 ' A' ' 138' ' ' VAL . 95.7 mtt180 -97.12 86.03 3.85 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 117.359 0.579 . . . . 2.0499999999999998 110.211 176.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -66.56 -47.48 72.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 3.27 111.419 -177.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -55.95 -51.1 68.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.761 0.315 . . . . 1.3500000000000001 111.166 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.15 -38.8 84.21 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.861 -0.335 . . . . 1.21 110.993 -177.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.69 -48.4 80.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.932 0.396 . . . . 0.20000000000000001 110.361 -178.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -55.24 -43.94 75.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.334 -0.393 . . . . 2.0 111.043 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.85 -47.68 82.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.396 -0.365 . . . . 0.39000000000000001 111.054 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.4 t -57.4 -46.29 85.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 121.015 -0.274 . . . . 0.28000000000000003 110.534 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -53.0 -48.87 67.19 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.76 0.314 . . . . 3.3399999999999999 111.417 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -55.93 -39.06 71.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 1.6499999999999999 110.981 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -62.17 -40.54 96.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.52 -0.309 . . . . 2.23 110.707 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 77.9 mt -65.82 -37.99 87.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 1.46 111.121 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -55.96 -38.26 70.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.522 -0.308 . . . . 4.3600000000000003 111.078 -178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 51.1 t60 -129.18 100.9 5.79 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.811 0.339 . . . . 6.46 110.451 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -66.54 -55.44 15.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 7.9000000000000004 110.767 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -150.1 -68.15 0.2 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 9.9700000000000006 110.628 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -120.96 -41.03 2.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.356 -0.384 . . . . 12.9 110.606 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -106.54 139.27 41.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.286 -0.415 . . . . 16.02 110.605 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 77.2 m80 . . . . . 0 C--O 1.22 -0.47 0 CA-C-O 117.976 -1.012 . . . . 15.33 110.568 179.982 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.3 mtm . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.0 t -59.84 -43.23 91.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.006 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.04 146.49 43.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.63 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.6 m -129.23 142.11 44.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.36 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 60.6 p -94.03 148.03 22.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.767 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -60.74 -29.2 69.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.954 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.92 -36.3 74.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.534 0.207 . . . . 0.0 111.239 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.2 mtp -55.98 -46.38 78.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.936 0.398 . . . . 0.0 110.822 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.9 mt -56.32 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.787 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.0 -49.12 78.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.282 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.5 -52.97 57.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.302 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -56.87 -44.35 82.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.014 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.41 -40.13 89.89 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.665 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.82 -44.5 86.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.877 0.37 . . . . 0.0 110.382 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -61.52 -48.04 82.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.541 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.07 -42.69 90.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.873 -179.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 52.3 t-20 -61.45 -44.95 96.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.082 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -59.43 -45.28 92.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.988 0.423 . . . . 0.0 110.179 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -125.36 109.47 12.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.318 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 146' ' ' ILE . 28.0 mt -96.76 -11.96 24.33 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -89.09 13.72 12.41 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.5 t -107.99 94.78 13.41 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.19 178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -48.84 -36.06 32.69 Favored 'Trans proline' 0 N--CA 1.497 1.695 0 C-N-CA 121.366 1.378 . . . . 0.0 113.057 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -57.38 -54.43 46.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.27 -41.3 84.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.557 -179.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -59.56 -46.42 88.95 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.695 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.71 -46.73 74.24 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.944 0.402 . . . . 0.0 110.472 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.39 93.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.217 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -59.18 -45.02 92.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.976 0.417 . . . . 0.0 110.839 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.6 m-85 -57.63 -46.4 84.18 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.254 0.55 . . . . 0.0 110.084 -178.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 53.7 mttt -58.69 -46.34 87.48 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.674 -178.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.2 mt -58.33 -43.97 88.46 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.566 -178.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.27 -41.21 96.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.957 -176.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.457 HD12 HD22 ' A' ' 155' ' ' LEU . 14.3 mt -64.11 -46.06 85.88 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.588 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -58.64 -40.98 84.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.759 0.314 . . . . 0.0 110.973 -177.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.2 m -84.58 15.3 3.85 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -176.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 26.4 t30 62.55 50.37 3.61 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.467 0.651 . . . . 0.0 110.87 177.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -124.85 49.33 3.14 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.353 177.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.479 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.1 Cg_endo -57.19 -39.08 93.15 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.116 1.211 . . . . 0.0 111.751 -174.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.98 -38.06 69.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 -179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -68.43 -42.3 79.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.027 0.442 . . . . 0.0 110.08 -179.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.42 -42.77 69.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.181 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -65.97 -52.31 50.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.593 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 86.5 p -54.91 -38.02 67.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.836 0.351 . . . . 0.0 111.199 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -72.44 -53.74 11.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.553 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -56.65 -31.6 64.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -176.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -76.82 -13.98 59.95 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -82.32 107.9 10.2 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.201 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_exo -57.56 -16.35 23.74 Favored 'Trans proline' 0 N--CA 1.501 1.946 0 C-N-CA 121.238 1.292 . . . . 0.0 113.484 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.52 77.17 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 121.244 -0.503 . . . . 0.0 112.966 -177.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.402 HG12 HD22 ' A' ' 115' ' ' LEU . 75.8 mt -100.02 141.4 17.16 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 117.57 0.685 . . . . 0.0 110.404 -176.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.39 156.18 26.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.722 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -143.81 137.82 28.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.411 175.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -124.67 165.03 27.24 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.417 177.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -45.91 -44.83 18.17 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 C-N-CA 121.442 1.428 . . . . 0.0 112.508 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -58.39 -43.81 88.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.269 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 79.6 m -59.65 -41.22 90.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.646 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.05 -45.4 87.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.356 -178.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.03 -45.97 89.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.127 0.489 . . . . 0.0 110.272 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.479 HD13 ' CB ' ' A' ' 125' ' ' TYR . 41.6 mt -58.24 -41.6 84.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.63 -179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.545 ' CE2' HD11 ' A' ' 160' ' ' LEU . 47.0 t80 -59.52 -46.51 88.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.454 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.7 ttp -57.57 -45.03 85.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.44 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.08 -46.16 88.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.501 -177.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.14 -43.51 92.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.408 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.545 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.1 mt -56.42 -43.55 79.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.99 0.424 . . . . 0.0 110.625 -178.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.75 -46.23 89.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.222 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 33.0 mtp85 -56.69 -40.65 75.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -176.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.479 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.6 pt -87.97 13.98 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -175.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.63 19.57 79.84 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.358 -0.449 . . . . 0.0 113.289 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.417 ' HD2' HD11 ' A' ' 163' ' ' ILE . 84.1 mtt-85 -97.14 85.98 3.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.678 0.739 . . . . 0.0 110.138 176.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -68.33 -47.63 67.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.43 -176.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 84.5 p -56.04 -51.04 69.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.767 0.318 . . . . 0.0 111.181 -176.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.475 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.6 mt-10 -59.56 -39.45 84.1 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.894 -0.322 . . . . 0.0 110.974 -177.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.6 -47.81 82.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.331 . . . . 0.0 110.587 -177.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.48 -45.02 77.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.928 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.83 -49.86 75.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.284 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 49.3 t -57.73 -48.34 83.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.691 -178.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -53.82 -49.98 67.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.397 -178.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -56.08 -39.64 72.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.941 179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -58.61 -39.96 81.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.792 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.2 mt -58.69 -40.81 84.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.752 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -66.39 -41.61 89.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.723 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -146.59 142.9 28.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.623 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 82.4 t60 -106.18 131.27 53.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.448 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -133.75 177.38 7.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.49 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -96.41 142.01 29.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.492 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -102.94 139.26 38.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.604 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.565 179.984 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.3 m -132.55 154.83 40.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.585 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.95 134.91 34.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.61 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.1 t -119.08 136.13 57.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.936 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.4 m -60.04 113.02 2.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.488 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -73.78 -38.61 64.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.987 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.91 88.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.73 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.3 mmm -56.74 -50.18 73.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.849 0.357 . . . . 0.0 110.801 -178.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.4 mt -55.72 -47.12 77.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.037 -178.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.95 -49.09 78.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.457 -175.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.8 m -54.39 -52.29 62.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.95 0.405 . . . . 0.0 111.186 -178.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.9 mmt85 -56.78 -44.52 81.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -60.51 -40.52 91.73 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.739 -0.384 . . . . 0.0 110.679 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -58.34 -44.15 88.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.84 0.352 . . . . 0.0 110.409 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -61.02 -47.07 88.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.542 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.5 -46.23 89.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.676 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -59.49 -42.3 91.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.975 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.5 tttp -59.28 -46.52 88.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.079 0.466 . . . . 0.0 110.053 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -126.49 110.34 13.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.391 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.43 -11.95 26.74 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.13 14.91 14.69 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 18.9 t -108.13 94.81 13.78 Favored Pre-proline 0 CA--C 1.533 0.29 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.358 178.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -48.87 -34.66 29.08 Favored 'Trans proline' 0 N--CA 1.497 1.684 0 C-N-CA 121.37 1.38 . . . . 0.0 113.071 -174.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.09 -55.2 38.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.894 0.378 . . . . 0.0 110.584 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.09 -41.67 84.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.593 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.422 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.4 mm-40 -59.72 -45.89 90.8 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 120.351 -0.54 . . . . 0.0 109.675 -178.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.01 -46.73 75.24 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 110.466 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.15 -44.37 92.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.311 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.36 -44.87 92.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 110.776 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.4 m-85 -57.61 -46.39 84.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.277 0.56 . . . . 0.0 110.054 -178.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.9 mttt -59.04 -45.51 90.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.732 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 37.6 mt -58.55 -44.66 89.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.513 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -61.11 -40.97 95.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.926 -176.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.511 HD12 HD22 ' A' ' 155' ' ' LEU . 14.9 mt -64.33 -46.04 85.22 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.583 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.07 -40.59 85.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.7 0.286 . . . . 0.0 110.981 -177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 63.7 m -85.36 17.14 3.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 61.53 50.9 4.3 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.424 0.631 . . . . 0.0 110.751 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.591 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.266 177.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.25 -39.5 89.6 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.134 1.222 . . . . 0.0 111.707 -174.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.5 -38.41 69.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.935 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.83 -41.88 77.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.969 0.414 . . . . 0.0 110.169 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.55 -42.45 68.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.205 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.6 t -66.44 -52.88 41.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.676 -177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.8 m -54.46 -38.3 66.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.925 0.393 . . . . 0.0 111.24 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -72.44 -53.62 11.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.487 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -56.46 -31.69 64.24 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.81 -13.19 60.04 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 21.0 m -84.29 107.73 11.93 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.266 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -57.59 -14.78 17.96 Favored 'Trans proline' 0 N--CA 1.501 1.959 0 C-N-CA 121.224 1.282 . . . . 0.0 113.57 -174.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -22.98 77.19 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.932 -177.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -100.02 140.74 18.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 117.49 0.645 . . . . 0.0 110.301 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.422 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.93 156.1 21.84 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.754 -176.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -141.79 137.88 31.86 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.477 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 92.8 p -125.64 163.51 38.45 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.361 177.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_exo -46.0 -44.96 18.37 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.445 1.43 . . . . 0.0 112.488 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.0 mp0 -58.76 -44.05 90.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.275 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 60.4 m -59.59 -41.28 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.544 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.81 -45.1 86.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.435 -178.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -59.17 -46.12 89.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.191 0.519 . . . . 0.0 110.272 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.511 HD22 HD12 ' A' ' 129' ' ' LEU . 37.0 mt -58.73 -41.6 86.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.621 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.524 ' CE2' HD11 ' A' ' 160' ' ' LEU . 38.8 t80 -59.14 -46.37 88.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.164 0.507 . . . . 0.0 110.394 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.5 ttp -57.21 -44.56 83.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.527 -179.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.78 -46.65 87.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.511 -177.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.13 -44.0 92.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.279 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.524 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.8 mt -56.32 -43.35 78.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 110.672 -178.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.37 -46.35 88.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.242 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -57.38 -40.7 78.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.288 -176.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 43.7 pt -89.05 14.06 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -175.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.99 24.45 75.81 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.467 -0.397 . . . . 0.0 113.141 173.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 55.6 mtp85 -97.12 91.0 5.35 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.515 0.658 . . . . 0.0 110.109 176.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -70.7 -44.75 66.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.55 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.6 t -55.99 -51.04 69.14 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.964 -0.295 . . . . 0.0 111.346 -174.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -62.51 -38.17 88.87 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.099 -176.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.92 -47.09 86.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.861 0.362 . . . . 0.0 110.466 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -56.16 -44.79 79.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.925 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.73 -48.57 79.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.23 -179.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.1 t -57.68 -47.64 85.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.589 -179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -53.22 -50.0 65.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.528 -178.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -56.47 -38.31 71.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.175 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -65.28 -41.97 93.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.213 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 81.5 mt -68.37 -38.85 81.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.155 -177.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -69.71 -39.17 77.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.126 -177.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -104.42 176.66 5.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.761 -178.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -95.51 165.24 12.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.374 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -97.65 134.85 40.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.557 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -115.98 142.94 46.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -124.05 133.08 53.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.42 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.597 179.899 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.2 mtp . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.4 m -132.28 152.88 37.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.558 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.95 146.06 28.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.676 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -104.01 133.67 47.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 109.981 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.5 p -74.95 157.27 35.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.628 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -61.61 -36.68 81.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.308 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.08 89.25 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 121.017 -0.273 . . . . 0.0 110.935 -177.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.2 mtp -57.53 -48.06 80.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.801 0.334 . . . . 0.0 110.716 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.418 HD23 ' HB3' ' A' ' 127' ' ' LEU . 34.7 mt -55.36 -49.71 71.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.094 -178.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.52 -49.07 79.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.487 -175.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.4 m -54.24 -52.83 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 111.26 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 87.4 mmt-85 -57.2 -44.24 83.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.89 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -60.26 -40.47 90.45 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.614 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -58.58 -45.63 88.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.837 0.351 . . . . 0.0 110.398 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.92 -46.82 89.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.616 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.77 90.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.57 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -59.0 -43.11 91.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.921 -177.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.71 -47.2 87.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.026 0.441 . . . . 0.0 110.177 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -121.54 108.76 13.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.392 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.0 mt -95.93 -11.88 25.95 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.19 14.92 14.76 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 27.6 t -108.63 94.87 14.96 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.332 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -48.86 -35.3 30.78 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.373 1.382 . . . . 0.0 113.05 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.56 -55.14 38.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.877 0.37 . . . . 0.0 110.653 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -41.67 83.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.563 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -59.67 -45.87 90.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.349 -0.541 . . . . 0.0 109.753 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.98 -46.76 75.13 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.976 0.417 . . . . 0.0 110.386 -176.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.22 92.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.216 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -59.16 -44.98 92.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.85 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.486 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.3 m-85 -57.65 -46.4 84.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.319 0.58 . . . . 0.0 110.093 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.0 mttp -58.73 -46.34 87.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.638 -178.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.418 ' HB3' HD23 ' A' ' 104' ' ' LEU . 42.5 mt -58.19 -44.08 87.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.578 -178.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.4 mt -60.98 -40.99 95.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.931 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.467 HD12 HD22 ' A' ' 155' ' ' LEU . 14.8 mt -64.36 -46.09 84.95 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.596 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.87 -40.3 83.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.736 0.303 . . . . 0.0 110.996 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -85.7 16.24 4.12 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 29.5 m120 61.93 51.03 3.89 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 121.462 0.648 . . . . 0.0 110.715 176.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.83 49.99 3.67 Favored Pre-proline 0 CA--C 1.541 0.613 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.297 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.414 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.5 Cg_endo -56.85 -38.92 94.76 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.18 1.253 . . . . 0.0 111.5 -175.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.12 -38.02 70.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.007 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -68.06 -42.24 80.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.986 0.422 . . . . 0.0 110.122 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.53 -42.38 68.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.17 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.69 -53.34 39.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 -177.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 24.9 m -54.65 -38.13 66.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.88 0.372 . . . . 0.0 111.212 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.86 -53.38 11.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.521 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -57.69 -30.53 65.56 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.876 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -76.89 -14.27 59.9 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -177.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 30.5 m -82.66 107.6 9.65 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.199 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.1 -16.98 29.53 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.19 1.26 . . . . 0.0 113.438 -174.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.38 77.01 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.314 -0.47 . . . . 0.0 113.011 -177.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.85 140.37 18.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.52 0.66 . . . . 0.0 110.401 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.7 156.08 24.62 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.621 0.724 . . . . 0.0 111.76 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.3 p -145.29 137.94 26.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.416 176.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.29 165.02 28.51 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.635 -0.712 . . . . 0.0 109.548 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -45.84 -44.41 18.34 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.467 1.445 . . . . 0.0 112.549 179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -59.17 -43.53 92.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.187 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 81.7 m -59.6 -41.43 90.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.606 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.5 mtp -58.12 -45.71 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.409 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.68 -45.4 89.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.313 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.486 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.3 mt -58.28 -42.51 86.74 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.509 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -58.8 -45.78 89.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.285 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.5 ttp -57.16 -44.33 83.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.503 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -59.09 -46.97 86.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.445 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.47 -43.04 88.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.444 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.417 HD22 ' OE1' ' A' ' 168' ' ' GLU . 92.9 mt -56.8 -43.87 81.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.498 -178.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -45.73 90.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.15 179.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -56.04 -42.97 77.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.214 -176.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.454 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.2 pt -90.47 14.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -174.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.59 27.1 70.05 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.021 173.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.454 ' NE ' HD12 ' A' ' 163' ' ' ILE . 85.8 mtt180 -97.08 88.81 4.6 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 117.315 0.558 . . . . 0.0 110.156 175.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -69.04 -49.43 57.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.306 -177.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -55.97 -51.1 68.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.78 0.324 . . . . 0.0 111.174 -176.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.417 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.8 mt-10 -59.67 -39.59 84.99 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.923 -177.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.28 -47.41 84.47 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.485 -177.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -55.52 -45.45 77.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.879 0.371 . . . . 0.0 110.98 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.86 -49.36 76.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.214 -178.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 47.6 t -58.97 -48.29 87.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.678 -178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 61.0 ttp85 -53.71 -45.29 70.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.396 -177.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -55.87 -39.74 71.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.944 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -64.03 -41.29 97.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.869 0.366 . . . . 0.0 110.554 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.56 -32.22 73.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.646 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -51.3 -35.23 36.78 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -60.88 151.18 30.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.729 0.3 . . . . 0.0 110.446 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -129.01 147.4 50.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.497 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -103.61 131.24 50.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.42 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -56.12 -39.32 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.02 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 74.1 m80 -95.03 148.47 22.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.644 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.405 179.74 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.6 p -135.83 141.64 41.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.333 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.65 148.11 50.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.565 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.4 p -133.92 143.86 37.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.158 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 t -83.29 113.0 20.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.64 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -74.7 -35.13 62.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.344 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.99 88.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.666 0.269 . . . . 0.0 110.856 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp -56.04 -49.23 74.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.817 0.342 . . . . 0.0 110.964 -178.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.512 HD11 ' OG ' ' A' ' 131' ' ' SER . 14.5 mt -53.35 -52.02 60.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.205 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.35 -49.06 75.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.795 -174.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -53.57 -54.07 42.7 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.598 -175.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.594 ' HD2' HD11 ' A' ' 127' ' ' LEU . 85.5 mtt180 -63.2 -38.26 90.48 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.844 -177.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -60.85 -39.47 89.25 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.529 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -59.24 -47.74 84.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.852 0.358 . . . . 0.0 110.194 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.81 -44.84 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.577 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.04 -47.55 85.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.621 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -59.5 -41.39 89.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.079 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -60.19 -47.63 85.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.085 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -121.62 109.72 15.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.32 178.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -94.65 -11.85 28.5 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.2 p -92.1 15.03 14.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.3 t -108.74 94.91 15.25 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 119.262 -0.399 . . . . 0.0 110.282 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -48.88 -36.77 34.9 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.319 1.346 . . . . 0.0 113.03 -175.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -57.19 -54.09 50.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.924 0.392 . . . . 0.0 110.689 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.06 -42.34 85.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.59 -179.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.5 mm-40 -59.49 -45.54 91.39 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.758 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.41 -46.69 73.22 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.005 0.431 . . . . 0.0 110.471 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.6 92.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.239 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.93 -44.25 94.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.936 0.398 . . . . 0.0 110.858 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.495 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.2 m-85 -57.4 -45.97 83.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.324 0.583 . . . . 0.0 110.034 -179.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 32.9 mttm -59.16 -44.68 92.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.659 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.594 HD11 ' HD2' ' A' ' 107' ' ' ARG . 13.3 mt -58.06 -46.39 85.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.312 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 23.7 mt -60.04 -40.64 90.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.973 -175.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.479 HD12 HD22 ' A' ' 155' ' ' LEU . 16.6 mt -65.14 -46.16 82.09 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.692 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.03 -39.44 81.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.755 0.312 . . . . 0.0 111.092 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.512 ' OG ' HD11 ' A' ' 104' ' ' LEU . 63.9 m -86.92 16.97 4.39 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -176.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 62.27 50.27 3.92 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.458 0.646 . . . . 0.0 110.824 176.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -124.88 49.46 3.25 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.171 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.481 ' HB2' HG23 ' A' ' 163' ' ' ILE . 20.0 Cg_endo -57.58 -39.37 88.89 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.123 1.215 . . . . 0.0 111.544 -175.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -56.03 -37.64 69.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.047 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.98 79.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.919 0.39 . . . . 0.0 110.12 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.35 -41.88 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.23 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.12 -53.2 43.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.498 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.67 -38.35 66.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 111.234 -176.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -72.99 -53.2 11.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.605 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -57.47 -30.77 65.34 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.791 -175.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -76.93 -12.79 60.0 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.334 0.865 . . . . 0.0 113.334 -177.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -84.36 107.41 10.89 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.661 -0.685 . . . . 0.0 110.294 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -58.13 -15.71 24.32 Favored 'Trans proline' 0 N--CA 1.502 1.978 0 C-N-CA 121.229 1.286 . . . . 0.0 113.549 -174.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -22.82 77.2 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 121.262 -0.494 . . . . 0.0 112.873 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -99.3 140.33 18.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 117.608 0.704 . . . . 0.0 110.36 -176.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.07 156.13 22.26 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.584 0.707 . . . . 0.0 111.79 -176.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.6 p -141.63 137.87 32.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.413 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 83.1 p -124.57 163.45 36.63 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.419 177.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -46.08 17.37 Favored 'Trans proline' 0 N--CA 1.498 1.785 0 C-N-CA 121.453 1.435 . . . . 0.0 112.307 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.18 -42.84 86.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.25 -42.44 95.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.56 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.42 ' CB ' HD21 ' A' ' 176' ' ' LEU . 23.6 mtp -57.99 -44.32 87.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.029 0.442 . . . . 0.0 110.456 -178.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -59.04 -46.19 88.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.191 0.519 . . . . 0.0 110.179 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.495 HD13 ' CB ' ' A' ' 125' ' ' TYR . 41.8 mt -57.7 -42.17 83.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.46 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.404 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.8 t80 -59.25 -46.62 88.01 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.429 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.4 ttp -57.39 -44.04 84.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.526 -178.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.43 -46.81 87.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.494 -178.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.66 -42.97 89.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.067 0.461 . . . . 0.0 110.465 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.457 HD22 ' OE1' ' A' ' 168' ' ' GLU . 92.8 mt -56.4 -43.74 79.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.61 -45.85 90.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.209 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -56.14 -41.52 75.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.256 -177.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.481 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.4 pt -88.51 14.19 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.53 22.2 79.1 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 121.373 -0.442 . . . . 0.0 113.206 174.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -97.1 85.97 3.85 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 117.58 0.69 . . . . 0.0 110.189 176.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -68.25 -46.92 69.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.296 -177.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 22.6 m -56.02 -51.08 69.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.79 0.329 . . . . 0.0 111.136 -176.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.457 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.1 mt-10 -59.47 -39.22 83.0 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.968 -177.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.23 -47.88 82.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.8 0.333 . . . . 0.0 110.538 -177.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -55.64 -44.59 77.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.991 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.99 -49.52 76.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.221 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 52.2 t -57.19 -48.5 82.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.636 -178.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -54.29 -50.13 68.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.199 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -56.56 -40.52 75.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.818 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -60.54 -37.84 82.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.115 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.42 HD21 ' CB ' ' A' ' 153' ' ' MET . 25.3 mt -74.42 140.94 45.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.88 0.371 . . . . 0.0 110.756 -179.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -128.88 128.57 44.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.274 179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 71.9 t60 -141.57 166.23 25.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.65 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -98.63 138.97 35.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.408 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -80.29 99.97 8.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.643 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 76.2 m80 -67.05 -40.81 87.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.739 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -78.68 136.73 37.52 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.567 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.574 -179.991 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 44.3 ttm . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.8 t -106.61 132.94 52.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.021 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.36 140.54 55.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.584 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -125.09 133.9 68.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.219 -0.446 . . . . 0.0 109.922 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 53.8 m -93.97 149.15 21.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.622 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -59.41 -35.53 74.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.333 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.96 -38.55 79.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.68 0.276 . . . . 0.0 110.958 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.8 mtp -56.31 -45.19 80.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 110.771 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 85.8 mt -56.39 -47.85 78.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.818 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.4 -48.98 79.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.297 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.48 -53.06 56.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.891 0.377 . . . . 0.0 111.329 -178.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -56.35 -44.47 80.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.076 -178.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.56 -40.43 91.58 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.644 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -58.16 -44.4 87.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.383 . . . . 0.0 110.435 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.64 -47.53 85.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.439 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.29 -46.04 89.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.658 -178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -59.05 -42.58 90.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.88 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -59.25 -46.81 87.51 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.091 0.472 . . . . 0.0 110.07 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -124.42 108.67 12.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.262 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.415 HD22 HG12 ' A' ' 146' ' ' ILE . 90.6 mt -94.84 -11.85 28.07 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.9 15.01 13.97 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 16.7 t -108.83 94.92 15.47 Favored Pre-proline 0 CA--C 1.533 0.314 0 CA-C-O 119.193 -0.432 . . . . 0.0 110.283 178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -48.93 -34.96 30.34 Favored 'Trans proline' 0 N--CA 1.496 1.661 0 C-N-CA 121.344 1.362 . . . . 0.0 112.889 -175.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -57.68 -54.86 42.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.908 0.385 . . . . 0.0 110.672 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.95 84.77 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.557 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.435 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.0 mm-40 -59.42 -45.3 91.92 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.812 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.93 -47.46 74.4 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.911 0.386 . . . . 0.0 110.388 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.21 -44.39 92.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.338 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -58.92 -44.9 91.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.869 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.462 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.4 m-85 -57.72 -46.47 84.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.338 0.589 . . . . 0.0 110.188 -178.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 47.4 mttt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.619 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.6 mt -58.39 -44.31 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.496 -178.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.7 mt -61.48 -41.21 96.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.03 -176.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 155' ' ' LEU . 20.1 mt -64.17 -46.16 85.22 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -59.08 -40.66 85.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.107 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.2 m -84.82 16.12 3.52 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.1 m-20 61.76 51.14 3.99 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.547 0.689 . . . . 0.0 110.676 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.83 49.36 3.15 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.302 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.516 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.2 Cg_endo -56.63 -39.85 88.47 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.144 1.23 . . . . 0.0 111.588 -175.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -55.71 -38.22 69.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.065 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.26 -42.66 79.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.031 0.443 . . . . 0.0 110.094 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.5 t -55.39 -42.84 69.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.158 179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.8 t -66.13 -52.09 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.578 -177.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -54.57 -38.23 66.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.923 0.392 . . . . 0.0 111.259 -176.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.2 ttt85 -72.57 -53.84 10.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.576 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -56.72 -31.28 64.36 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -176.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.59 59.99 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.6 m -83.7 107.54 10.58 Favored Pre-proline 0 CA--C 1.536 0.407 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.214 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -57.78 -16.26 24.63 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 C-N-CA 121.266 1.311 . . . . 0.0 113.573 -174.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.62 77.15 Favored Glycine 0 CA--C 1.532 1.097 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.972 -177.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.415 HG12 HD22 ' A' ' 115' ' ' LEU . 73.0 mt -99.62 139.76 20.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 117.524 0.662 . . . . 0.0 110.34 -176.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.435 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.72 156.06 17.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.673 0.749 . . . . 0.0 111.635 -177.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.7 p -149.14 137.88 21.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.399 176.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 p -124.9 165.03 27.74 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.442 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -45.97 -44.77 18.45 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 C-N-CA 121.472 1.448 . . . . 0.0 112.48 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -58.07 -44.47 87.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.987 0.422 . . . . 0.0 110.289 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.5 m -59.11 -41.41 88.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 24.3 mtp -57.71 -43.57 85.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.456 -178.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.71 -46.26 87.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.121 0.486 . . . . 0.0 110.169 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.462 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.5 mt -58.54 -41.9 86.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.532 ' CE2' HD11 ' A' ' 160' ' ' LEU . 47.9 t80 -58.75 -45.67 89.18 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.174 0.511 . . . . 0.0 110.358 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.411 ' HB2' HG11 ' A' ' 172' ' ' VAL . 59.7 ttp -58.62 -44.25 89.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.586 -179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -58.59 -45.74 88.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.47 -178.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.4 91.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.345 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.532 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.6 mt -56.33 -42.9 78.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.689 -178.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.14 -46.85 87.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.214 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 22.0 mtp85 -56.12 -41.84 75.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.236 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.516 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.5 pt -88.39 13.95 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 70.24 24.18 76.81 Favored Glycine 0 CA--C 1.529 0.959 0 C-N-CA 121.398 -0.429 . . . . 0.0 113.056 174.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 80.8 mtt-85 -97.02 85.95 3.86 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 117.47 0.635 . . . . 0.0 110.287 176.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -67.08 -47.17 72.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.319 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 21.1 m -56.01 -50.95 69.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.861 0.362 . . . . 0.0 111.173 -176.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.428 ' OE1' HD22 ' A' ' 160' ' ' LEU . 92.9 mt-10 -60.26 -38.17 82.67 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.913 -177.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -60.67 -47.82 84.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.143 0.497 . . . . 0.0 110.2 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -55.44 -42.45 74.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.975 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.9 -48.75 78.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.021 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.411 HG11 ' HB2' ' A' ' 157' ' ' MET . 46.6 t -55.79 -46.13 79.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.566 0.222 . . . . 0.0 110.69 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -52.98 -49.97 65.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.786 0.326 . . . . 0.0 111.308 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.05 -39.81 72.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.891 179.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -60.25 -39.64 87.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.82 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.0 mt -79.1 136.54 37.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.431 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -146.53 -56.98 0.28 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.79 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -111.76 127.12 55.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.676 -178.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -149.97 105.85 3.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.492 179.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -150.01 -69.27 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.688 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -98.33 -40.41 8.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.784 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -60.58 143.42 53.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.591 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.685 -179.806 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.7 ttm . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.434 HG23 ' N ' ' A' ' 98' ' ' ALA . 35.3 m -123.35 -39.71 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.72 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.434 ' N ' HG23 ' A' ' 97' ' ' VAL . . . -66.63 146.61 54.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.546 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.7 m -130.19 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.362 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 79.4 p -91.82 151.05 20.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.654 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -78.92 -24.81 43.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.034 -0.53 . . . . 0.0 112.347 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.93 -38.54 79.19 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.629 0.252 . . . . 0.0 110.936 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 73.3 mtm -56.35 -46.56 79.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.891 0.377 . . . . 0.0 110.787 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.7 mt -56.43 -47.0 79.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.8 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.0 79.49 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.237 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.37 -53.24 53.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.907 0.384 . . . . 0.0 111.404 -178.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 83.1 mmt-85 -56.57 -44.09 80.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.055 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -60.43 -40.63 91.76 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.581 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.94 -43.96 86.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.97 0.414 . . . . 0.0 110.439 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -60.77 -47.91 84.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.478 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.12 -45.7 90.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.636 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -59.04 -42.88 91.3 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.819 -178.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -59.29 -46.51 88.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.076 0.465 . . . . 0.0 109.991 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -125.68 109.08 12.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.386 177.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -95.27 -11.9 27.13 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.6 p -91.33 14.86 13.34 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.2 t -108.78 94.79 15.08 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-O 119.273 -0.394 . . . . 0.0 110.244 178.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.8 -34.75 28.89 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.302 1.335 . . . . 0.0 113.037 -175.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -57.71 -55.15 38.61 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.665 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.34 83.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.495 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.407 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.9 mm-40 -59.64 -46.09 90.04 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.361 -0.536 . . . . 0.0 109.668 -179.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.75 -46.82 74.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.95 0.405 . . . . 0.0 110.434 -176.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.52 -44.47 93.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.278 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.85 -44.95 91.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.489 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.8 m-85 -57.85 -46.62 84.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.267 0.556 . . . . 0.0 110.045 -178.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 61.1 mttt -58.63 -45.44 89.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.699 -178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 42.7 mt -58.43 -44.97 89.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.553 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.15 -40.62 94.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.884 -176.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.473 HD12 HD22 ' A' ' 155' ' ' LEU . 16.3 mt -64.34 -46.09 85.01 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.619 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -58.69 -40.93 85.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.015 -177.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.61 16.1 3.41 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 62.0 50.58 4.04 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.431 0.634 . . . . 0.0 110.78 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.85 49.4 3.19 Favored Pre-proline 0 CA--C 1.539 0.522 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.167 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.507 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.9 Cg_endo -57.61 -38.55 93.17 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.091 1.194 . . . . 0.0 111.688 -174.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.09 -38.19 70.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.936 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.0 -42.5 80.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.017 0.437 . . . . 0.0 110.081 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.0 t -55.53 -42.81 69.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.204 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -65.92 -52.34 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.54 -177.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.6 67.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.776 0.322 . . . . 0.0 111.157 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.2 -53.19 13.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.55 -178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -56.55 -32.5 65.2 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.656 -176.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -76.85 -11.34 59.81 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 -176.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -85.01 107.34 11.35 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-O 118.753 -0.641 . . . . 0.0 110.253 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -57.79 -15.64 22.19 Favored 'Trans proline' 0 N--CA 1.502 1.998 0 C-N-CA 121.26 1.307 . . . . 0.0 113.499 -174.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.85 -22.6 77.01 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 121.333 -0.46 . . . . 0.0 112.972 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.7 mt -99.99 140.29 19.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 117.515 0.657 . . . . 0.0 110.339 -176.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.407 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.7 156.1 17.61 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.593 0.711 . . . . 0.0 111.722 -176.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.81 137.88 29.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.465 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 95.8 p -125.98 163.35 40.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.391 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.02 -45.37 17.78 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.446 1.43 . . . . 0.0 112.422 178.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -58.26 -43.2 87.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.962 0.41 . . . . 0.0 110.369 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.4 m -59.98 -41.87 92.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.462 ' HB3' HD21 ' A' ' 176' ' ' LEU . 23.3 mtp -57.91 -44.8 87.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.964 0.411 . . . . 0.0 110.403 -178.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.81 -45.75 89.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.303 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.489 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.5 mt -58.62 -40.91 84.68 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.615 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.556 ' CE2' HD11 ' A' ' 160' ' ' LEU . 53.2 t80 -59.46 -47.41 85.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.106 0.479 . . . . 0.0 110.495 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 60.1 ttp -57.65 -44.54 85.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.459 -178.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.26 -45.88 90.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.459 -177.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.95 -43.82 91.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.137 0.494 . . . . 0.0 110.496 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.556 HD11 ' CE2' ' A' ' 156' ' ' TYR . 92.8 mt -56.58 -43.29 79.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.535 -178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.83 -46.07 90.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.308 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.6 mtp180 -56.39 -40.81 75.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.225 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.507 HG23 ' HB2' ' A' ' 134' ' ' PRO . 39.6 pt -87.53 13.99 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -175.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.65 17.64 80.04 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 121.326 -0.464 . . . . 0.0 113.429 174.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt-85 -97.14 86.01 3.84 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 117.704 0.752 . . . . 0.0 110.097 176.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -71.99 -44.56 63.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.218 -176.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -56.14 -50.93 69.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 111.093 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.458 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.2 mt-10 -59.08 -41.08 87.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.948 -177.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.0 -47.55 84.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.67 -177.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.51 -45.57 77.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.956 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.92 -49.27 77.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.307 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.405 HG21 ' CE2' ' A' ' 156' ' ' TYR . 51.6 t -57.23 -50.53 76.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.735 -178.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . 0.442 ' HA ' HD12 ' A' ' 176' ' ' LEU . 76.2 ttt180 -54.11 -49.98 67.91 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.733 0.301 . . . . 0.0 111.319 -177.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -58.27 -37.95 76.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.008 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -65.21 -32.87 74.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.769 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.462 HD21 ' HB3' ' A' ' 153' ' ' MET . 79.5 mt -57.16 -58.79 6.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.67 0.272 . . . . 0.0 111.422 -177.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -78.49 -46.16 20.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.461 -176.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -55.04 -43.03 73.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.188 -177.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 69.9 m80 -102.81 152.29 21.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.615 -179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -73.19 154.62 40.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.581 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -56.95 -43.96 82.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.695 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -61.4 -45.72 93.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.58 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.596 179.941 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.9 ttm . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.4 m -132.55 154.87 40.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.517 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.45 134.61 35.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.593 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.5 m -131.29 151.0 34.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.46 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.2 p -93.95 153.34 18.26 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.636 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.2 p80 -59.14 -31.0 68.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.716 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.97 -40.8 85.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.686 0.279 . . . . 0.0 110.78 -178.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.9 mtp -57.09 -48.4 78.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.014 0.435 . . . . 0.0 110.65 -179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.0 mt -56.36 -44.55 80.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.739 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -49.07 79.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.269 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.2 m -53.48 -53.63 48.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.856 0.36 . . . . 0.0 111.306 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -56.47 -44.13 80.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.021 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -60.6 -40.56 92.23 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.657 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -57.94 -44.14 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.812 0.339 . . . . 0.0 110.408 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -60.89 -48.0 83.8 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.568 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.75 90.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.686 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -60.27 -44.05 95.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.919 -178.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -58.9 -45.23 90.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.059 0.457 . . . . 0.0 110.127 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -126.41 107.69 10.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.324 177.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.5 mt -95.03 -11.94 27.5 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 177.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.2 p -91.68 15.06 13.48 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -107.85 94.87 13.3 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 119.284 -0.388 . . . . 0.0 110.151 178.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -48.85 -34.43 28.26 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.413 1.408 . . . . 0.0 113.056 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -58.24 -55.21 37.98 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.587 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.41 82.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.609 -179.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.408 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.1 mm-40 -59.71 -46.36 89.35 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.756 -179.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.69 -46.79 74.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.921 0.391 . . . . 0.0 110.486 -176.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.32 -45.21 91.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.263 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -59.13 -43.95 91.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.897 -178.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.497 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.8 m-85 -57.58 -46.23 84.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 110.15 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -59.05 -44.85 91.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.678 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.54 -45.28 89.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.528 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.9 mt -60.44 -41.11 93.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.92 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.5 HD12 HD22 ' A' ' 155' ' ' LEU . 16.3 mt -64.05 -46.15 85.64 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.666 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -58.85 -40.34 83.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.756 0.313 . . . . 0.0 111.147 -177.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.4 m -84.49 15.61 3.62 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 62.14 50.53 3.93 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.463 0.649 . . . . 0.0 110.727 176.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -124.93 49.44 3.25 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.228 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.486 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.1 Cg_endo -57.15 -39.67 88.88 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.135 1.224 . . . . 0.0 111.673 -175.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -55.46 -38.03 68.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.995 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.46 -42.42 78.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.943 0.402 . . . . 0.0 110.135 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.2 t -55.37 -42.25 66.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.192 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.25 -52.45 47.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.552 -177.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -54.74 -38.62 67.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.837 0.351 . . . . 0.0 111.204 -176.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.1 ttt85 -72.21 -53.31 12.97 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.531 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -56.58 -31.6 64.38 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 -176.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -76.89 -12.62 59.98 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 22.4 m -84.66 107.44 11.33 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.149 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.91 -14.83 19.62 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 C-N-CA 121.232 1.288 . . . . 0.0 113.581 -174.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -23.03 77.19 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 121.196 -0.526 . . . . 0.0 112.906 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -99.85 140.16 19.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 117.446 0.623 . . . . 0.0 110.235 -176.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.408 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.36 156.1 19.81 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.507 0.67 . . . . 0.0 111.65 -177.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.4 p -144.19 137.93 27.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.404 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.11 165.12 29.36 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.477 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -45.94 -44.31 18.85 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.442 1.428 . . . . 0.0 112.474 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -58.43 -44.86 89.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.962 0.41 . . . . 0.0 110.258 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.2 m -59.1 -41.62 88.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.458 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -57.77 -45.74 85.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.956 0.408 . . . . 0.0 110.39 -178.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -58.83 -45.67 89.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.216 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.5 HD22 HD12 ' A' ' 129' ' ' LEU . 38.1 mt -58.77 -41.06 85.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.68 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.562 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.3 t80 -59.53 -47.33 85.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.129 0.49 . . . . 0.0 110.456 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.6 ttp -57.53 -44.14 84.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.451 -178.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -59.3 -46.38 88.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.565 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.121 0.486 . . . . 0.0 110.415 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.562 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.8 mt -56.48 -43.25 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.642 -178.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.91 -46.27 89.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.379 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 -56.41 -40.47 74.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.241 -177.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.486 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.0 pt -87.49 13.98 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 113.456 0.909 . . . . 0.0 113.456 -175.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 78.61 15.26 81.1 Favored Glycine 0 CA--C 1.533 1.169 0 C-N-CA 121.322 -0.466 . . . . 0.0 113.506 174.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.433 ' HD2' HD11 ' A' ' 163' ' ' ILE . 86.8 mtt-85 -97.11 85.92 3.83 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.777 0.789 . . . . 0.0 110.144 177.34 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -72.87 -44.81 60.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.28 -176.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.3 m -56.03 -50.95 69.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.808 0.337 . . . . 0.0 111.1 -176.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.525 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.0 mt-10 -59.17 -39.14 81.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.933 -177.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.1 -48.06 81.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.882 0.372 . . . . 0.0 110.582 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -55.67 -44.8 77.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.939 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.91 -49.58 76.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.244 -179.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 53.8 t -56.94 -48.2 81.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.991 -0.283 . . . . 0.0 110.677 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -54.02 -49.98 67.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.698 0.285 . . . . 0.0 111.258 -178.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -56.94 -39.4 74.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.845 178.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -56.98 -38.53 73.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.006 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 79.4 mt -64.79 88.03 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.789 0.328 . . . . 0.0 110.497 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -72.25 -38.52 68.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.016 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -93.86 145.74 24.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.828 0.346 . . . . 0.0 110.709 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -108.07 150.59 26.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.383 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -78.67 100.1 6.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.562 -179.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -91.5 -42.71 10.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.775 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -110.35 143.21 40.93 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.483 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.54 179.937 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.2 mtm . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.8 t -109.15 133.83 53.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.019 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.58 148.27 52.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.56 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.4 t -99.88 134.32 39.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.024 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 57.5 m -67.19 140.45 57.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -65.21 -30.38 71.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.835 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -35.66 73.56 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.468 0.175 . . . . 0.0 111.365 -177.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 86.1 mtp -55.89 -48.88 74.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.933 0.397 . . . . 0.0 110.85 -179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 83.6 mt -56.59 -44.4 81.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.759 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.04 79.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.334 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.31 -53.25 53.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.998 0.428 . . . . 0.0 111.346 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -56.86 -45.6 82.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.926 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -59.88 -39.28 84.76 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.761 -179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -58.06 -45.14 87.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.91 0.386 . . . . 0.0 110.336 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -60.29 -48.07 83.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.362 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.03 -45.87 89.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.603 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -59.32 -42.25 90.99 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -59.02 -46.33 88.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.022 0.439 . . . . 0.0 110.073 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -127.07 110.91 13.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.495 177.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 96.5 mt -94.13 -11.87 29.6 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 178.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.29 15.08 12.73 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.9 t -108.13 94.79 13.72 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-O 119.271 -0.395 . . . . 0.0 110.332 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -48.93 -39.09 39.85 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 121.381 1.387 . . . . 0.0 113.14 -175.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -56.81 -51.71 67.91 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.825 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.38 -42.99 92.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.841 -0.344 . . . . 0.0 110.568 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 45.6 mm-40 -59.3 -45.19 91.97 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.76 -179.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.22 -47.21 72.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.978 0.418 . . . . 0.0 110.454 -176.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.46 -44.93 92.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.21 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -58.76 -44.51 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.94 0.4 . . . . 0.0 110.839 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.493 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.1 m-85 -57.65 -46.8 83.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.277 0.561 . . . . 0.0 110.041 -178.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -58.56 -46.04 87.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.697 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.2 mt -58.31 -44.22 88.48 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.571 -178.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.3 mt -60.79 -41.28 95.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.866 -176.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.464 HD12 HD22 ' A' ' 155' ' ' LEU . 16.4 mt -64.47 -46.17 84.23 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.742 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -59.17 -39.82 83.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.056 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 73.6 m -84.76 15.4 3.91 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -176.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 62.46 50.1 3.81 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.499 0.666 . . . . 0.0 110.869 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -124.88 48.91 2.82 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.421 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.86 -38.27 93.17 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.147 1.231 . . . . 0.0 111.643 -175.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -56.22 -38.21 70.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.01 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -68.06 -42.12 80.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.044 0.45 . . . . 0.0 110.109 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.62 -43.25 72.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.145 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 45.8 t -65.95 -52.21 51.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.6 -177.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.8 m -55.02 -39.06 68.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.831 0.348 . . . . 0.0 111.092 -176.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -72.36 -51.95 18.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.547 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -57.0 -31.62 65.28 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -176.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -76.89 -10.06 59.11 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 12.7 m -86.26 106.87 11.22 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 118.74 -0.647 . . . . 0.0 110.211 178.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -57.64 -15.0 18.85 Favored 'Trans proline' 0 N--CA 1.5 1.898 0 C-N-CA 121.311 1.341 . . . . 0.0 113.571 -174.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.94 -23.25 77.11 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 121.286 -0.483 . . . . 0.0 112.872 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.6 mt -98.64 139.77 19.83 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 117.542 0.671 . . . . 0.0 110.385 -176.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.14 156.1 19.04 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.665 -177.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -144.6 137.84 27.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.515 176.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -125.86 164.97 29.86 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.414 177.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -45.81 -43.35 19.29 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 121.454 1.436 . . . . 0.0 112.488 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 -59.88 -43.93 94.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.098 178.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 76.1 m -59.65 -41.46 90.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.572 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.3 mtp -58.13 -45.47 87.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.979 0.419 . . . . 0.0 110.342 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.51 -45.29 89.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.204 0.526 . . . . 0.0 110.231 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.493 HD13 ' CB ' ' A' ' 125' ' ' TYR . 38.7 mt -59.28 -41.22 88.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.611 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.541 ' CE2' HD11 ' A' ' 160' ' ' LEU . 49.1 t80 -58.08 -45.2 87.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.07 0.462 . . . . 0.0 110.218 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 16.5 ttm -57.74 -45.91 85.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -57.81 -45.26 86.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.513 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.07 -45.75 91.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.969 0.414 . . . . 0.0 110.306 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.541 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.1 mt -56.59 -43.34 80.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.037 0.446 . . . . 0.0 110.532 -178.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -60.5 -44.39 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.391 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 18.0 mtp180 -56.42 -42.67 78.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.153 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.44 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.8 pt -88.49 14.15 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -174.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.9 23.34 69.57 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 121.276 -0.487 . . . . 0.0 113.305 172.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.44 ' NE ' HD12 ' A' ' 163' ' ' ILE . 92.5 mtt180 -97.11 85.99 3.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 117.448 0.624 . . . . 0.0 110.172 175.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -67.9 -49.85 59.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.282 -176.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.2 m -55.89 -51.12 68.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.738 0.304 . . . . 0.0 111.301 -175.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.519 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.7 mt-10 -59.43 -40.73 87.68 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.049 -176.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.16 -47.41 84.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.847 0.356 . . . . 0.0 110.667 -177.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -55.63 -45.32 77.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.962 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.92 -50.09 74.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.325 -179.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.1 t -57.48 -49.02 81.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.984 -0.286 . . . . 0.0 110.672 -177.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -54.61 -49.86 69.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.254 -178.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.03 -39.3 71.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.076 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -58.27 -40.34 81.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.828 0.347 . . . . 0.0 110.771 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.9 mt -61.1 -38.65 87.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.933 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -56.63 -38.93 72.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.944 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -100.33 174.25 6.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.833 0.349 . . . . 0.0 110.578 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.2 m80 -95.35 167.5 11.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.567 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -95.04 134.62 37.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.484 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -57.61 -61.09 2.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.739 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 21.7 m80 -150.03 136.2 18.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.676 179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.505 179.861 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.2 t -106.81 133.27 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.019 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.07 135.59 36.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.562 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.6 p -137.17 141.32 40.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.211 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 42.6 t -94.04 137.81 32.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.636 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -64.51 -36.84 85.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.229 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.49 84.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.762 0.315 . . . . 0.0 110.76 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.8 mtt -56.79 -43.61 81.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.836 0.35 . . . . 0.0 110.751 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.6 mt -56.18 -49.65 73.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.824 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.0 -49.05 79.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.249 -176.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.4 m -53.4 -53.02 57.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.848 0.356 . . . . 0.0 111.393 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.0 mmt-85 -56.37 -44.3 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.992 -178.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -60.04 -41.73 92.92 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.609 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -58.31 -44.03 88.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.79 0.329 . . . . 0.0 110.437 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -61.16 -47.12 87.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.547 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.52 -46.22 89.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.593 -179.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -59.7 -41.91 91.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.886 -177.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.2 tttt -59.5 -46.88 87.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.134 0.492 . . . . 0.0 109.977 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -123.54 106.3 10.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.197 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -93.44 -12.0 30.81 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -92.26 15.0 14.66 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.6 t -108.03 94.84 13.6 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-O 119.265 -0.398 . . . . 0.0 110.351 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_exo -48.75 -34.79 28.69 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.432 1.421 . . . . 0.0 113.155 -174.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -58.59 -54.91 41.77 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.621 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.24 -41.1 83.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.53 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.46 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.1 mm-40 -59.77 -46.84 87.93 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.694 -178.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.79 -46.84 74.51 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.925 0.393 . . . . 0.0 110.518 -176.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.27 -44.68 92.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -59.65 -44.22 93.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.922 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.491 ' CB ' HD13 ' A' ' 155' ' ' LEU . 66.7 m-85 -57.65 -46.23 84.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.321 0.582 . . . . 0.0 110.117 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -59.3 -45.14 92.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.679 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 43.7 mt -59.05 -44.75 91.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.6 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 15.0 mt -61.11 -41.11 96.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.912 -176.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.535 HD12 HD22 ' A' ' 155' ' ' LEU . 14.4 mt -64.17 -46.05 85.71 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.634 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.15 -40.57 85.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.713 0.292 . . . . 0.0 110.931 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.9 m -84.36 16.31 3.15 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -176.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 61.78 50.62 4.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.477 0.656 . . . . 0.0 110.842 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -124.86 48.58 2.64 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.58 -39.46 88.13 Favored 'Trans proline' 0 N--CA 1.497 1.726 0 C-N-CA 121.109 1.206 . . . . 0.0 111.773 -174.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -55.55 -38.21 68.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.04 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.37 -42.86 78.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.019 0.438 . . . . 0.0 109.992 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.3 t -55.3 -42.63 67.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.307 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.7 t -67.05 -53.62 32.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.716 -176.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 21.6 t -54.83 -39.37 68.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.973 0.416 . . . . 0.0 111.153 -176.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.6 ttt-85 -72.98 -50.47 23.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.692 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.6 -32.84 65.65 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.584 -177.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -76.93 -7.55 55.76 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -177.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 39.2 m -86.67 106.73 11.31 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.757 -0.639 . . . . 0.0 110.105 178.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_exo -57.42 -13.96 14.8 Favored 'Trans proline' 0 N--CA 1.502 2.002 0 C-N-CA 121.234 1.289 . . . . 0.0 113.667 -174.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.89 -24.13 76.58 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 121.252 -0.499 . . . . 0.0 112.857 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.2 mt -98.01 142.04 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 117.386 0.593 . . . . 0.0 110.397 -176.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.46 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.27 156.21 26.21 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.554 -177.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.1 p -146.19 137.86 24.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.543 176.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -123.56 165.09 24.64 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.365 177.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.91 -44.97 18.02 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.439 1.426 . . . . 0.0 112.509 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.44 -43.31 88.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.909 0.385 . . . . 0.0 110.318 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.0 m -60.11 -42.86 95.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.865 0.364 . . . . 0.0 110.589 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.6 ' SD ' HD21 ' A' ' 176' ' ' LEU . 23.5 mtp -57.97 -43.4 86.44 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.441 -178.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -59.04 -46.45 88.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.146 0.498 . . . . 0.0 110.083 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.535 HD22 HD12 ' A' ' 129' ' ' LEU . 35.6 mt -58.52 -41.0 84.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.647 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.505 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 38.7 t80 -58.81 -45.35 90.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.084 0.469 . . . . 0.0 110.387 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 15.1 ttm -57.92 -45.82 85.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.407 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -57.84 -45.49 86.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.521 -176.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -60.15 -45.73 92.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.979 0.419 . . . . 0.0 110.402 -178.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.505 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 90.4 mt -56.65 -42.68 79.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.005 0.431 . . . . 0.0 110.629 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -60.99 -45.37 95.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.408 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.3 mtp180 -56.63 -41.36 77.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.114 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -87.44 13.99 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -175.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.89 21.36 79.84 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.428 -0.415 . . . . 0.0 113.265 173.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -97.02 85.91 3.85 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 117.626 0.713 . . . . 0.0 110.146 176.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -70.06 -46.39 65.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.351 -176.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 85.8 p -56.06 -50.95 69.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.793 0.33 . . . . 0.0 111.127 -175.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.491 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.2 mt-10 -59.24 -39.45 82.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.918 -177.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.23 -47.74 83.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.83 0.348 . . . . 0.0 110.633 -177.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -55.28 -45.26 76.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.99 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.85 -49.54 76.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.155 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 51.2 t -57.03 -48.56 81.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 120.936 -0.305 . . . . 0.0 110.701 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 77.6 ttt-85 -53.9 -50.02 67.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 111.332 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -56.63 -39.78 74.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.869 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -57.07 -36.83 71.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.136 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.6 HD21 ' SD ' ' A' ' 153' ' ' MET . 81.7 mt -77.9 123.6 26.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.778 0.323 . . . . 0.0 110.79 -179.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 40.1 mp0 -85.86 -41.54 14.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.611 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -111.25 146.41 37.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.696 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 59.1 t60 -137.11 137.19 39.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.436 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -103.81 133.67 48.4 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.576 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -58.23 -40.6 82.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.733 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -79.91 144.32 33.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.564 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.581 -179.872 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.1 t -116.41 132.08 67.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.927 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.8 145.31 55.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.525 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.429 ' O ' HG23 ' A' ' 99' ' ' VAL . 22.4 m -91.42 123.02 43.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.649 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.9 t -93.97 146.25 24.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.739 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -54.84 -35.28 63.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.292 178.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.95 -34.26 71.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.392 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 65.2 mtt -55.2 -44.97 75.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.921 0.391 . . . . 0.0 110.943 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.2 mt -56.49 -47.65 78.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.745 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -58.5 -48.98 79.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.121 -177.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.03 -53.2 53.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.892 0.377 . . . . 0.0 111.474 -178.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 82.7 mmt-85 -56.28 -44.51 79.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.954 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -60.34 -39.93 88.87 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.68 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -57.99 -44.14 87.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.976 0.417 . . . . 0.0 110.389 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -60.88 -47.43 86.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.526 -179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.36 -45.39 91.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.664 -179.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -59.32 -42.83 92.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.905 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -59.51 -47.08 86.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.087 0.47 . . . . 0.0 109.982 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -124.4 108.81 12.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.302 177.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.9 mt -95.92 -11.92 25.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.33 14.76 13.62 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -178.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.0 t -108.53 94.78 14.55 Favored Pre-proline 0 CA--C 1.533 0.294 0 O-C-N 122.042 -0.411 . . . . 0.0 110.183 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.86 -34.37 28.12 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.431 1.421 . . . . 0.0 112.894 -175.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -58.13 -55.33 36.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.816 0.341 . . . . 0.0 110.679 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.02 81.62 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.569 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.436 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.7 mm-40 -59.85 -46.46 89.22 Favored 'General case' 0 N--CA 1.461 0.12 0 C-N-CA 120.382 -0.527 . . . . 0.0 109.672 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.47 74.09 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.936 0.398 . . . . 0.0 110.506 -176.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.43 -44.99 92.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.247 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -58.72 -45.01 90.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 110.869 -179.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.481 ' CB ' HD13 ' A' ' 155' ' ' LEU . 66.1 m-85 -57.64 -46.55 84.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.371 0.605 . . . . 0.0 110.104 -178.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.5 mttt -58.82 -45.59 89.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.757 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.8 mt -58.47 -44.47 89.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.522 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.0 mt -61.16 -41.13 96.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.959 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.497 HD12 HD22 ' A' ' 155' ' ' LEU . 13.8 mt -64.1 -46.07 85.85 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.492 179.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.53 -41.44 85.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.738 0.304 . . . . 0.0 111.0 -177.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 71.8 m -84.52 16.11 3.35 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -176.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 61.88 51.18 3.87 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.474 0.654 . . . . 0.0 110.695 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -124.91 49.77 3.53 Favored Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.116 177.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.406 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.8 Cg_endo -56.42 -39.87 88.39 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 C-N-CA 121.183 1.256 . . . . 0.0 111.575 -175.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.57 -38.1 68.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.114 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.32 -42.4 79.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.07 0.462 . . . . 0.0 110.117 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.75 -42.47 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.185 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.0 t -66.23 -52.19 50.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.571 -177.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -54.54 -38.15 66.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.858 0.361 . . . . 0.0 111.23 -176.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.7 ttt85 -72.89 -53.94 10.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.499 -178.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -56.64 -31.21 64.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.85 -13.35 60.01 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.9 m -84.67 107.06 9.98 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.207 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -58.16 -15.22 22.31 Favored 'Trans proline' 0 N--CA 1.501 1.912 0 C-N-CA 121.31 1.34 . . . . 0.0 113.571 -174.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -23.55 76.99 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 121.305 -0.474 . . . . 0.0 112.856 -177.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.9 mt -98.15 139.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 117.529 0.664 . . . . 0.0 110.362 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.436 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.32 156.05 16.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.693 0.759 . . . . 0.0 111.594 -176.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.1 p -143.33 137.95 29.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.348 176.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.5 p -125.35 163.48 38.07 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.304 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -45.96 -45.11 17.97 Favored 'Trans proline' 0 N--CA 1.498 1.781 0 C-N-CA 121.378 1.385 . . . . 0.0 112.476 178.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -58.36 -43.97 88.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.317 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 61.6 m -59.81 -41.5 91.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.569 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -57.91 -44.94 87.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.954 0.407 . . . . 0.0 110.442 -178.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.95 -46.22 88.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 110.248 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.497 HD22 HD12 ' A' ' 129' ' ' LEU . 40.6 mt -58.26 -40.83 82.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.678 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.52 ' CE2' HD11 ' A' ' 160' ' ' LEU . 43.1 t80 -59.37 -47.62 84.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.211 0.529 . . . . 0.0 110.415 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.2 ttp -57.43 -42.93 83.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.541 -178.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . 0.435 ' OE1' HD13 ' A' ' 129' ' ' LEU . 92.4 mt-10 -59.22 -47.38 85.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.543 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.77 -43.45 90.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.019 0.437 . . . . 0.0 110.364 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.52 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.7 mt -56.68 -43.77 80.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.588 -178.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.3 -46.04 89.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.151 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 29.4 mtp85 -56.42 -42.19 77.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.284 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.421 HD12 ' NE ' ' A' ' 165' ' ' ARG . 38.3 pt -89.47 14.16 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -174.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.65 25.59 69.56 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.309 -0.472 . . . . 0.0 113.154 173.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.421 ' NE ' HD12 ' A' ' 163' ' ' ILE . 87.9 mtt180 -97.06 89.01 4.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 117.448 0.624 . . . . 0.0 110.109 175.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -68.45 -51.14 46.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.379 -176.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.2 t -55.98 -51.06 69.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 0.0 111.214 -175.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.468 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.5 mt-10 -59.51 -40.8 88.27 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.986 -176.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.98 -46.94 87.06 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.618 -177.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.34 -45.97 76.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.981 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.96 -49.61 76.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.359 -178.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.09 -48.83 83.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.746 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 70.6 ttp85 -54.14 -48.43 70.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.283 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -55.93 -39.77 72.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.947 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -61.41 -40.99 96.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.68 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.5 mt -62.82 -40.35 97.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.792 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -60.61 -41.49 94.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.737 -179.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -148.18 141.74 25.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.63 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -95.86 147.11 24.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.561 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -120.86 157.23 30.25 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.433 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -56.84 -40.52 76.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.737 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -84.25 145.57 28.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.493 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.535 -179.834 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.2 mtm . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.9 t -110.52 134.22 53.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.253 -0.431 . . . . 0.0 109.993 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.34 149.61 50.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.541 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.5 m -128.73 151.05 34.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.5 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 74.8 m -63.71 119.71 10.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.617 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.73 -34.59 45.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.46 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.05 -39.24 81.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.664 0.269 . . . . 0.0 110.931 -178.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 95.0 mmm -56.74 -47.8 79.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.908 0.385 . . . . 0.0 110.721 -179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.9 mt -56.09 -45.86 79.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.831 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.04 78.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.367 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.19 -52.86 57.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.971 0.415 . . . . 0.0 111.344 -178.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -56.86 -46.14 81.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.014 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.99 -39.01 84.27 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.752 -179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -57.89 -45.2 86.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.48 -47.12 87.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.481 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.52 89.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.628 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -59.46 -42.2 91.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -58.85 -45.5 89.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.126 0.489 . . . . 0.0 110.098 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -126.22 104.85 8.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.117 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 97.1 mt -90.6 -11.86 38.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 177.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.75 15.05 15.45 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -178.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 2.9 t -107.41 94.88 12.37 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.251 -0.404 . . . . 0.0 110.376 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -48.8 -39.2 38.91 Favored 'Trans proline' 0 N--CA 1.496 1.653 0 C-N-CA 121.447 1.431 . . . . 0.0 113.37 -174.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -57.33 -49.57 75.71 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.78 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.13 98.5 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.39 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.453 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 46.3 mm-40 -59.06 -45.82 89.82 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.61 -47.31 73.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.422 -176.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.49 91.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.311 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -59.66 -44.29 93.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 110.931 -179.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.479 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.5 m-85 -57.58 -46.41 84.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.352 0.596 . . . . 0.0 110.111 -178.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 36.1 mttm -58.98 -45.22 91.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.709 -178.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 48.9 mt -58.35 -44.92 88.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.575 -178.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.6 mt -60.79 -41.65 96.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.926 -176.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.568 HD12 HD22 ' A' ' 155' ' ' LEU . 15.2 mt -63.74 -46.13 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.621 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -58.6 -41.06 84.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.986 -177.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.3 m -84.42 15.67 3.54 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.5 m120 61.98 50.76 3.97 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.481 0.658 . . . . 0.0 110.769 177.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.91 49.16 3.02 Favored Pre-proline 0 CA--C 1.54 0.569 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.323 177.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.02 -39.36 91.91 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 121.15 1.233 . . . . 0.0 111.687 -175.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.93 -37.98 69.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.959 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.13 -41.97 80.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.03 0.443 . . . . 0.0 110.129 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.6 t -55.22 -43.23 69.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.153 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.5 t -65.41 -52.17 54.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.587 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.4 m -54.83 -38.61 67.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 0.0 111.172 -176.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.1 ttt85 -72.19 -53.45 12.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.604 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -56.74 -31.56 64.67 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.756 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -76.84 -13.11 60.04 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 32.9 m -83.36 107.63 10.49 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.194 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.69 -15.8 22.33 Favored 'Trans proline' 0 N--CA 1.501 1.955 0 C-N-CA 121.215 1.277 . . . . 0.0 113.543 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.99 -22.76 77.24 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.242 -0.504 . . . . 0.0 112.883 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 75.2 mt -99.88 141.59 16.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 117.615 0.707 . . . . 0.0 110.34 -176.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.453 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -63.15 156.13 26.05 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.753 -176.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.5 p -141.71 137.79 31.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.478 176.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 90.1 p -123.9 163.44 35.3 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.365 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -45.99 -46.0 16.66 Favored 'Trans proline' 0 N--CA 1.498 1.775 0 C-N-CA 121.424 1.416 . . . . 0.0 112.442 178.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -58.15 -43.06 87.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.363 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.3 m -60.08 -42.12 93.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.885 0.374 . . . . 0.0 110.601 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.8 mtp -58.02 -44.64 87.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.332 -178.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -58.85 -45.97 88.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.151 0.5 . . . . 0.0 110.252 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.568 HD22 HD12 ' A' ' 129' ' ' LEU . 36.4 mt -58.84 -41.46 86.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.585 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.537 ' CE2' HD11 ' A' ' 160' ' ' LEU . 45.5 t80 -58.62 -46.29 87.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.128 0.49 . . . . 0.0 110.351 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.0 ttp -57.6 -45.18 85.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.41 -45.64 87.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.599 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.45 92.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.461 -178.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.541 HD22 ' OE1' ' A' ' 168' ' ' GLU . 95.6 mt -56.69 -43.33 80.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.581 -178.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -59.75 -46.53 88.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.278 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.5 mtp85 -56.62 -40.36 75.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.187 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 42.3 pt -88.4 14.0 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -175.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.05 14.67 82.38 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 121.415 -0.421 . . . . 0.0 113.592 173.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 61.7 mtt85 -97.15 86.02 3.85 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 117.831 0.816 . . . . 0.0 110.334 177.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -74.12 -39.74 63.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.394 -176.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 86.1 p -56.03 -51.04 69.2 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.909 0.385 . . . . 0.0 110.991 -176.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.541 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.2 mt-10 -59.88 -36.88 77.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.098 -178.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.37 -48.39 81.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.991 0.424 . . . . 0.0 110.355 -178.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -55.66 -43.71 76.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.936 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.91 -48.27 80.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.963 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 51.6 t -57.45 -45.98 85.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.493 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 -52.95 -48.87 67.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.407 -179.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -55.9 -39.6 71.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.973 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -64.39 -36.73 85.1 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.208 179.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.9 mt -77.94 123.97 27.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.866 0.365 . . . . 0.0 110.767 -178.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -78.73 -38.84 37.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.91 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -54.75 -39.13 67.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.133 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -74.84 130.18 38.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.47 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -114.02 132.18 56.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.505 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -61.15 -41.24 96.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.61 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -120.22 141.03 50.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.493 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.562 -179.985 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 21.7 ttt . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -102.25 132.42 48.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.018 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.73 139.29 47.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.633 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.3 t -126.87 135.18 64.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.875 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 49.9 p -67.84 154.82 40.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.555 -179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -70.15 -35.33 73.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.544 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.96 -42.16 89.19 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.979 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.5 mtp -60.19 -48.09 83.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.921 0.391 . . . . 0.0 110.446 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.0 mt -56.54 -44.87 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.796 -179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -49.08 78.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.407 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.3 m -54.01 -53.02 58.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.939 0.4 . . . . 0.0 111.244 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 88.2 mmt-85 -56.73 -44.38 81.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.005 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -60.55 -40.35 91.25 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.693 -178.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -58.3 -43.95 88.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.913 0.387 . . . . 0.0 110.373 -178.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -60.76 -47.71 85.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.56 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.18 -46.35 88.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.642 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.96 -42.0 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.861 -178.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.9 ttmp? -59.65 -46.93 87.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.066 0.46 . . . . 0.0 110.063 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -124.93 109.98 13.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.451 178.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.8 mt -95.8 -11.91 26.14 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 178.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.3 p -91.41 14.99 13.14 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.57 94.85 17.43 Favored Pre-proline 0 CA--C 1.533 0.308 0 CA-C-O 119.306 -0.378 . . . . 0.0 110.248 178.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -49.0 -34.69 29.98 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 C-N-CA 121.341 1.361 . . . . 0.0 112.867 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -57.55 -55.38 35.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.84 0.352 . . . . 0.0 110.701 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.09 81.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.577 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.415 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 43.5 mm-40 -59.75 -46.37 89.37 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.684 -179.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.65 -46.77 74.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.918 0.389 . . . . 0.0 110.519 -176.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.22 -44.61 92.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.261 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -59.25 -44.71 92.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.978 0.418 . . . . 0.0 110.808 -179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.441 ' CB ' HD13 ' A' ' 155' ' ' LEU . 62.5 m-85 -57.66 -46.68 83.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.286 0.565 . . . . 0.0 110.141 -178.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 34.9 mttp -58.45 -46.73 85.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.54 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.18 -44.01 87.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.603 -177.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.2 mt -61.2 -41.3 96.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.988 -177.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.468 HD11 ' O ' ' A' ' 155' ' ' LEU . 23.2 mt -64.29 -46.11 85.08 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.645 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -59.39 -40.15 85.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.094 -177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 74.8 m -84.17 15.0 3.75 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 -176.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 62.6 50.52 3.49 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.475 0.655 . . . . 0.0 110.76 177.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -124.93 49.6 3.4 Favored Pre-proline 0 CA--C 1.541 0.601 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.177 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.521 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.3 Cg_endo -56.46 -40.53 83.98 Favored 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 121.17 1.247 . . . . 0.0 111.541 -175.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.13 -38.1 67.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.11 -179.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -68.28 -42.29 79.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.015 0.435 . . . . 0.0 110.021 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.61 -42.98 71.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.177 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 49.9 t -65.4 -51.92 58.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.572 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.5 t -54.73 -38.91 67.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.891 0.377 . . . . 0.0 111.258 -176.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.9 ttt85 -72.13 -53.07 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.539 -178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.69 -31.59 64.6 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -175.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -76.83 -14.52 59.9 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.5 m -81.83 107.81 9.42 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.789 -0.624 . . . . 0.0 110.232 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -57.98 -17.14 29.5 Favored 'Trans proline' 0 N--CA 1.502 1.997 0 C-N-CA 121.235 1.29 . . . . 0.0 113.51 -174.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -22.35 77.07 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.323 -0.465 . . . . 0.0 113.0 -177.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.47 139.83 20.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 117.557 0.679 . . . . 0.0 110.389 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.415 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -60.31 156.05 16.51 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.633 0.73 . . . . 0.0 111.712 -176.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -144.21 137.83 27.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.457 176.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 97.3 p -126.0 163.49 39.27 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.42 177.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -46.04 -45.31 17.95 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.428 1.419 . . . . 0.0 112.477 178.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.23 -43.83 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.34 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.2 m -59.22 -41.61 89.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.498 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.02 -44.94 87.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.003 0.43 . . . . 0.0 110.445 -178.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.6 -45.42 89.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.164 0.507 . . . . 0.0 110.308 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.468 ' O ' HD11 ' A' ' 129' ' ' LEU . 41.7 mt -59.22 -42.21 90.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.477 -179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.548 ' CE2' HD11 ' A' ' 160' ' ' LEU . 50.0 t80 -58.05 -45.12 87.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.201 0.524 . . . . 0.0 110.327 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.99 -46.08 85.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.393 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.24 -45.21 88.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.508 -177.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.54 92.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.075 0.464 . . . . 0.0 110.37 -178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.548 HD11 ' CE2' ' A' ' 156' ' ' TYR . 94.1 mt -56.17 -42.72 77.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.605 -178.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -59.83 -46.35 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.262 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 21.1 mtp180 -55.88 -41.57 74.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.156 -177.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.521 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.4 pt -88.77 14.06 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.35 20.57 79.92 Favored Glycine 0 CA--C 1.531 1.066 0 C-N-CA 121.38 -0.438 . . . . 0.0 113.31 174.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -97.12 85.92 3.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.637 0.719 . . . . 0.0 110.258 176.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -70.35 -45.04 66.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.311 -177.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.5 m -56.05 -51.02 69.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.807 0.337 . . . . 0.0 111.129 -176.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.48 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.0 mt-10 -59.29 -37.72 78.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.102 -178.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.84 -48.29 81.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.037 0.446 . . . . 0.0 110.403 -178.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -55.4 -44.11 75.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.951 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.87 -48.4 79.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.042 -179.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.5 t -57.52 -46.23 86.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.681 0.277 . . . . 0.0 110.408 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -52.94 -48.59 67.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.526 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -55.93 -39.08 71.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.051 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -62.99 -41.75 99.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.744 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.6 mt -64.78 -37.96 89.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.207 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -59.4 -36.84 76.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.261 -178.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -91.27 136.22 33.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.866 0.365 . . . . 0.0 110.751 -179.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -127.4 145.08 50.94 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.344 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -127.22 142.04 51.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.496 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -57.94 -41.13 82.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.664 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -95.52 131.95 41.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.565 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.566 -179.96 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.4 mtp . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.1 m -60.18 132.38 25.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.66 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.4 143.36 42.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.589 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.3 t -105.65 134.11 48.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.91 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 78.3 p -94.08 150.07 20.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.613 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -63.95 -35.94 82.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.273 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.93 -36.18 74.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.224 -179.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.6 ttm -55.38 -44.63 76.24 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.913 0.387 . . . . 0.0 110.9 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.8 mt -55.8 -48.57 75.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.855 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -49.02 79.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -176.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.9 m -53.15 -53.24 53.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.009 0.433 . . . . 0.0 111.439 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -56.91 -44.52 82.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.978 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -59.53 -40.43 87.15 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.507 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -58.32 -45.09 88.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.873 0.368 . . . . 0.0 110.33 -178.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -60.36 -47.27 86.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.504 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.3 -44.59 92.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.69 -179.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -59.61 -43.2 93.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.863 -178.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -59.3 -46.84 87.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.026 0.441 . . . . 0.0 110.029 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -124.06 108.76 12.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.386 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.5 mt -95.43 -11.86 26.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.9 p -92.33 14.99 14.82 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 26.2 t -108.4 94.84 14.39 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 122.033 -0.417 . . . . 0.0 110.326 178.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -48.87 -34.89 29.77 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 121.345 1.363 . . . . 0.0 113.028 -175.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.94 -55.05 39.93 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.653 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.91 84.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.561 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.403 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.7 mm-40 -59.8 -45.52 92.08 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.678 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.57 75.46 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.969 0.414 . . . . 0.0 110.432 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.38 93.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.322 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -58.99 -44.9 91.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.788 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -57.8 -47.46 82.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.283 0.563 . . . . 0.0 110.029 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -57.97 -46.27 85.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.607 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.0 mt -58.58 -44.32 89.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.562 -177.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.4 HD22 ' HB2' ' A' ' 136' ' ' TYR . 19.0 mt -60.34 -40.82 92.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.876 -177.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.86 -46.03 83.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.796 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.85 -39.74 82.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.974 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.3 m -85.33 15.15 4.56 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 -176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 62.48 50.43 3.65 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 121.459 0.647 . . . . 0.0 110.848 177.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.395 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.553 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.8 Cg_endo -56.14 -39.18 92.87 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.305 1.337 . . . . 0.0 111.523 -176.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -55.63 -38.26 69.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.06 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.4 ' HB2' HD22 ' A' ' 128' ' ' LEU . 17.3 m-85 -67.97 -42.83 80.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.019 0.438 . . . . 0.0 110.024 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.3 t -55.37 -42.09 65.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 55.7 t -65.84 -53.1 41.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.536 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 25.4 m -54.46 -38.04 65.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.816 0.341 . . . . 0.0 111.24 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -72.98 -54.03 9.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.604 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -57.3 -30.3 64.63 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.784 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -76.96 -13.99 59.9 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 11.9 m -84.85 107.12 10.37 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.78 -0.628 . . . . 0.0 110.325 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -58.39 -15.18 23.28 Favored 'Trans proline' 0 N--CA 1.502 1.973 0 C-N-CA 121.219 1.28 . . . . 0.0 113.612 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.03 77.25 Favored Glycine 0 CA--C 1.532 1.121 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.896 -177.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.4 mt -98.65 140.18 18.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 117.49 0.645 . . . . 0.0 110.355 -176.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.403 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.64 156.14 20.72 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.544 0.688 . . . . 0.0 111.701 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 56.0 p -147.15 137.93 23.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.33 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -123.77 165.07 25.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.422 178.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.87 -43.96 18.92 Favored 'Trans proline' 0 N--CA 1.498 1.768 0 C-N-CA 121.434 1.423 . . . . 0.0 112.516 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.81 -45.94 88.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.257 177.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 72.1 m -58.0 -40.91 81.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.959 0.409 . . . . 0.0 110.513 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.52 -45.96 87.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.986 0.422 . . . . 0.0 110.456 -177.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -58.57 -44.37 89.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.255 0.55 . . . . 0.0 110.171 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 85.5 mt -57.86 -42.15 83.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.54 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.421 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 20.9 t80 -58.97 -46.95 86.84 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.344 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.27 -43.2 82.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.448 -179.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -59.32 -49.64 77.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.317 -178.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.21 -40.93 82.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.443 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.471 HD22 ' OE1' ' A' ' 168' ' ' GLU . 92.4 mt -56.93 -43.8 81.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.916 0.389 . . . . 0.0 110.444 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.64 -44.6 93.44 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.198 178.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 53.7 mtt-85 -55.58 -42.87 75.37 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.196 -176.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.553 HG23 ' HB2' ' A' ' 134' ' ' PRO . 26.1 pt -90.1 14.08 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.82 26.25 69.74 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 121.272 -0.49 . . . . 0.0 112.985 174.071 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -97.06 86.03 3.87 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 117.315 0.557 . . . . 0.0 109.952 175.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.62 -50.86 61.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.317 -176.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.0 t -55.91 -51.13 68.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.807 0.337 . . . . 0.0 111.281 -175.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.471 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.7 mt-10 -59.58 -40.97 89.12 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.033 -176.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.94 -47.27 85.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.86 0.362 . . . . 0.0 110.653 -177.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -55.62 -45.63 77.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.977 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.83 -49.8 75.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.35 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.8 t -56.98 -49.7 78.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.699 -178.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 77.0 ttt-85 -54.53 -50.02 68.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.285 -177.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.0 -40.19 76.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.777 0.322 . . . . 0.0 110.854 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -60.05 -41.75 92.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.59 -179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.3 mt -65.94 -39.6 90.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.917 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -61.24 -46.55 89.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.74 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -150.0 162.03 41.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.637 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -110.52 129.1 55.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.429 179.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -119.12 140.59 49.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.555 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -149.82 -66.17 0.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.515 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -56.81 -40.59 76.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.773 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.535 -179.967 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 94.2 mmm . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.44 HG23 ' N ' ' A' ' 98' ' ' ALA . 35.0 m -60.22 -39.92 82.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.827 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.44 ' N ' HG23 ' A' ' 97' ' ' VAL . . . -76.4 142.86 40.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.669 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.3 t -107.87 132.81 54.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.932 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.9 t -94.03 144.06 25.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.614 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -55.28 -36.68 66.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.214 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.94 -39.61 82.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.781 0.324 . . . . 0.0 110.799 -179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 66.4 mtt -56.28 -42.59 77.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.83 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 127' ' ' LEU . 26.7 mt -53.88 -52.19 61.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.036 0.446 . . . . 0.0 111.077 -178.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.33 -48.98 75.73 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.58 -175.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.2 m -53.08 -54.05 41.32 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.703 -175.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.543 ' HD2' HD11 ' A' ' 127' ' ' LEU . 81.5 mtt-85 -63.57 -37.74 88.45 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.846 -177.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -60.51 -39.93 89.59 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.485 178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -59.06 -46.5 88.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.871 0.367 . . . . 0.0 110.182 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.08 -45.7 92.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.519 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.76 -46.01 90.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.676 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -58.93 -43.1 91.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.898 -177.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -60.63 -47.2 87.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.941 0.4 . . . . 0.0 110.115 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -120.02 105.58 11.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.316 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -92.29 -12.01 33.64 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.96 15.04 14.02 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -177.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 13.7 t -107.75 94.66 12.69 Favored Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 118.046 0.385 . . . . 0.0 110.296 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.89 -39.68 39.72 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.44 1.427 . . . . 0.0 113.162 -175.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -56.52 -51.31 69.0 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.826 -178.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.57 -42.78 93.25 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.511 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -59.1 -45.39 90.99 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.783 -178.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.72 -47.11 74.16 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.934 0.397 . . . . 0.0 110.527 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -44.1 92.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.278 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -59.83 -44.85 93.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.493 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.3 m-85 -57.4 -46.41 83.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.349 0.595 . . . . 0.0 110.086 -178.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -58.78 -45.86 88.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.748 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.543 HD11 ' HD2' ' A' ' 107' ' ' ARG . 16.6 mt -58.2 -44.82 88.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.457 -178.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.6 mt -60.61 -40.68 92.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.932 -176.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.465 HD12 HD22 ' A' ' 155' ' ' LEU . 16.1 mt -64.66 -46.22 83.43 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.684 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.45 -39.48 83.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.071 -177.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.8 m -86.01 16.62 4.06 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 62.36 50.57 3.71 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.495 0.665 . . . . 0.0 110.857 176.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -124.9 49.08 2.95 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.21 177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.492 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.7 Cg_endo -57.23 -40.86 79.34 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.233 1.289 . . . . 0.0 111.629 -174.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.55 -37.79 68.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.037 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.22 -42.78 79.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.078 -178.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.43 -42.89 69.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.122 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.8 t -65.52 -52.19 54.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.572 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 m -54.91 -38.85 68.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.238 -176.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.04 -53.28 13.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.52 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.74 -32.6 65.72 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.011 -0.276 . . . . 0.0 111.661 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.83 -12.36 59.96 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 113.399 0.889 . . . . 0.0 113.399 -177.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 6.0 m -83.72 107.63 10.9 Favored Pre-proline 0 CA--C 1.536 0.405 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.146 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -57.66 -16.67 25.56 Favored 'Trans proline' 0 N--CA 1.501 1.964 0 C-N-CA 121.185 1.256 . . . . 0.0 113.489 -174.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.9 -22.25 76.97 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.962 -177.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.3 mt -100.21 140.96 18.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.597 0.698 . . . . 0.0 110.342 -176.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.66 156.11 20.83 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.629 0.728 . . . . 0.0 111.741 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -142.52 137.91 30.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.426 176.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 93.7 p -124.55 163.31 37.43 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.384 177.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -45.96 -45.01 18.12 Favored 'Trans proline' 0 N--CA 1.498 1.749 0 C-N-CA 121.483 1.455 . . . . 0.0 112.458 178.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.33 -43.24 88.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.378 177.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . 0.401 ' HA ' HD12 ' A' ' 155' ' ' LEU . 75.8 m -59.75 -41.62 91.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.989 0.423 . . . . 0.0 110.572 -179.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.12 -45.77 86.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.039 0.447 . . . . 0.0 110.432 -178.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.97 -45.54 90.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.203 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.493 HD13 ' CB ' ' A' ' 125' ' ' TYR . 44.8 mt -58.22 -41.38 83.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.596 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.555 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.9 t80 -59.36 -47.37 85.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.203 0.525 . . . . 0.0 110.467 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.8 ttp -57.72 -44.5 86.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.49 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -59.41 -45.97 90.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.562 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.09 -44.09 91.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.947 0.404 . . . . 0.0 110.32 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.555 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.4 mt -56.4 -43.29 79.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.681 -178.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.68 -46.36 89.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 8.7 mtp-105 -56.88 -40.92 77.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.271 -177.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.492 HG23 ' HB2' ' A' ' 134' ' ' PRO . 39.0 pt -87.57 14.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 -175.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.61 20.25 79.79 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-O 119.859 -0.412 . . . . 0.0 113.331 173.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -97.14 85.98 3.84 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 117.734 0.767 . . . . 0.0 110.011 176.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -66.09 -47.21 75.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.496 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 84.3 p -55.97 -51.06 69.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.78 0.324 . . . . 0.0 111.272 -175.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.492 ' OE1' HD22 ' A' ' 160' ' ' LEU . 88.9 mt-10 -60.85 -39.43 89.09 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.911 -0.316 . . . . 0.0 111.084 -176.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.25 -47.52 84.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.828 0.347 . . . . 0.0 110.621 -177.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -55.76 -44.98 78.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.959 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.08 77.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.217 -178.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 49.3 t -57.68 -49.4 80.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.685 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -54.14 -47.78 71.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.428 -177.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -55.99 -38.64 70.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.039 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -62.6 -39.43 93.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.868 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 78.5 mt -64.59 -43.97 92.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.911 -178.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -140.05 143.9 36.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.826 0.346 . . . . 0.0 110.77 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -120.21 143.77 48.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.492 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -119.61 145.86 46.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.428 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -98.94 107.29 19.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.547 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -60.54 -41.1 93.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.661 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 79.3 m80 -132.21 159.0 40.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.502 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.575 -179.981 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 72.1 mtm . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -108.07 133.0 54.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.019 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -84.0 140.07 32.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.582 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.2 t -104.54 134.17 46.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.95 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.1 m -94.03 146.31 24.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.655 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -61.33 -37.37 83.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.177 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.97 88.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.801 0.334 . . . . 0.0 110.764 -178.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 44.3 ttm -56.71 -47.54 79.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.931 0.396 . . . . 0.0 110.719 -179.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.4 mt -55.81 -46.39 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.79 -48.93 79.55 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.392 -176.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.1 m -53.4 -52.83 58.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.019 0.438 . . . . 0.0 111.397 -178.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -56.71 -45.66 81.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.059 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -60.25 -39.38 86.57 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.705 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.4 ' HG2' ' HZ2' ' A' ' 113' ' ' LYS . 38.7 tt0 -57.74 -44.36 85.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.061 0.458 . . . . 0.0 110.337 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -61.04 -48.66 80.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.496 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.57 -42.81 88.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.686 -179.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -59.11 -43.39 91.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 -178.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.4 ' HZ2' ' HG2' ' A' ' 109' ' ' GLN . 37.4 mttp -58.91 -46.94 86.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.117 0.484 . . . . 0.0 110.076 179.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -125.93 108.8 11.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.473 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.39 -11.96 26.81 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 177.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.7 p -91.61 14.73 14.23 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 23.1 t -107.87 94.82 13.23 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.066 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -48.78 -34.77 28.81 Favored 'Trans proline' 0 N--CA 1.497 1.703 0 C-N-CA 121.396 1.397 . . . . 0.0 113.114 -174.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.76 -55.41 35.18 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.652 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.67 85.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.555 -179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.9 mm-40 -59.28 -45.56 90.92 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.772 -179.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.74 -49.19 71.42 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.461 -176.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.75 89.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.37 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . 0.421 ' HA ' HD12 ' A' ' 127' ' ' LEU . 17.1 t80 -59.28 -44.36 92.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 -179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.483 ' CB ' HD13 ' A' ' 155' ' ' LEU . 58.4 m-85 -56.76 -43.98 81.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.349 0.595 . . . . 0.0 110.178 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -58.19 -48.21 81.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.938 -178.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 124' ' ' PHE . 44.3 mt -57.0 -43.88 82.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.612 -176.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.413 HD22 ' HB2' ' A' ' 136' ' ' TYR . 22.3 mt -61.22 -41.02 96.13 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.956 -177.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.454 HD12 HD22 ' A' ' 155' ' ' LEU . 14.0 mt -64.53 -46.05 84.56 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.298 -0.561 . . . . 0.0 110.511 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.72 -40.49 83.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.727 0.299 . . . . 0.0 111.092 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.9 m -85.44 15.98 4.09 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 20.4 m120 61.8 51.18 3.94 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.506 0.669 . . . . 0.0 110.718 177.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -124.87 49.88 3.59 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.149 177.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -56.44 -39.81 88.8 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.108 1.205 . . . . 0.0 111.58 -175.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -55.92 -38.15 69.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.353 . . . . 0.0 110.994 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . 0.413 ' HB2' HD22 ' A' ' 128' ' ' LEU . 4.1 m-85 -68.18 -42.54 79.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.04 0.448 . . . . 0.0 110.086 -178.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 60.7 t -55.75 -42.86 71.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.151 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.71 -52.12 54.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.647 -177.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.5 m -55.06 -38.69 68.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.82 0.343 . . . . 0.0 111.115 -176.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.8 ttt85 -72.03 -53.01 14.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.495 -178.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -56.61 -32.51 65.34 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.026 -0.27 . . . . 0.0 111.726 -176.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -76.98 -12.18 59.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -177.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.7 m -84.01 107.87 12.06 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.226 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -57.62 -16.3 23.84 Favored 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 121.263 1.309 . . . . 0.0 113.542 -174.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -22.66 77.19 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 121.228 -0.51 . . . . 0.0 112.902 -177.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 72.5 mt -100.89 140.32 20.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.574 0.687 . . . . 0.0 110.281 -176.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.21 156.16 22.68 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.69 0.757 . . . . 0.0 111.578 -177.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.5 p -143.03 137.81 29.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.411 175.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.7 p -126.1 165.09 29.55 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.463 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.88 -44.12 18.8 Favored 'Trans proline' 0 N--CA 1.499 1.798 0 C-N-CA 121.486 1.457 . . . . 0.0 112.424 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -58.6 -45.35 89.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.903 0.382 . . . . 0.0 110.288 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 64.4 m -58.78 -41.01 85.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.56 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.18 -45.47 87.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.435 -177.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -59.1 -46.36 88.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.098 0.475 . . . . 0.0 110.212 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.483 HD13 ' CB ' ' A' ' 125' ' ' TYR . 46.5 mt -58.1 -42.25 85.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.519 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.543 ' CE2' HD11 ' A' ' 160' ' ' LEU . 46.8 t80 -59.91 -45.99 90.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.659 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.4 ttp -57.72 -45.44 85.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.411 -178.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -58.73 -46.0 88.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.41 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.71 -44.19 90.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.09 0.472 . . . . 0.0 110.364 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.543 HD11 ' CE2' ' A' ' 156' ' ' TYR . 91.9 mt -56.58 -44.19 80.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.655 -178.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -58.95 -46.11 88.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 13.4 mtp180 -56.62 -41.02 76.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.226 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 45.5 pt -89.23 14.05 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.534 0.939 . . . . 0.0 113.534 -175.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 72.63 19.78 79.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 121.342 -0.456 . . . . 0.0 113.399 174.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 -97.17 91.87 5.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 117.598 0.699 . . . . 0.0 110.192 176.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -75.43 -40.26 57.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.366 -176.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.0 m -55.96 -51.07 69.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.752 0.311 . . . . 0.0 111.168 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.511 ' CB ' HD13 ' A' ' 160' ' ' LEU . 43.8 mt-10 -60.45 -38.83 85.39 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.966 -177.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.7 -47.5 85.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.879 0.371 . . . . 0.0 110.495 -177.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -55.88 -44.83 78.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.837 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.72 -48.74 78.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.269 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 50.0 t -57.72 -47.27 86.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.544 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -53.07 -49.71 65.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.652 0.263 . . . . 0.0 111.555 -178.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -56.01 -39.29 71.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.956 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -63.93 -40.25 96.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.862 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 80.2 mt -66.28 -37.99 86.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.148 -178.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -64.35 -46.22 84.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.943 -178.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -146.82 164.61 32.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.825 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -127.82 172.08 11.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.397 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -100.33 129.51 46.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.607 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -58.05 -42.4 85.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.6 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -138.75 143.66 39.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.563 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 . . . . . 0 C--O 1.219 -0.502 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.536 179.904 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 94.3 mmm . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.5 m -132.54 153.04 37.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.526 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.77 141.26 44.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.637 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -108.02 134.97 48.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.933 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 p -94.03 151.2 19.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.697 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -72.01 -27.09 62.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.198 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.93 -39.14 80.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.627 0.251 . . . . 0.0 110.906 -177.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.6 mtp -56.25 -47.76 77.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.871 0.367 . . . . 0.0 110.953 -179.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.1 mt -56.04 -47.34 78.06 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.956 -178.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.53 -49.18 78.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.386 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.0 m -53.88 -52.43 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.921 0.391 . . . . 0.0 111.243 -178.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -56.76 -45.7 81.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.994 -179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.62 -40.06 86.31 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.556 -178.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.33 -45.66 87.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.882 0.372 . . . . 0.0 110.401 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -60.25 -46.18 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.453 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.67 84.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.659 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.48 -40.51 87.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.939 -177.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.36 -46.8 87.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.052 0.453 . . . . 0.0 109.976 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -125.48 108.08 11.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.3 177.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.9 mt -93.39 -11.81 31.36 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.43 14.96 15.1 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.4 t -108.36 94.82 14.26 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 118.057 0.39 . . . . 0.0 110.291 178.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_exo -48.83 -34.45 28.18 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 121.417 1.411 . . . . 0.0 113.105 -175.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -58.32 -55.2 38.06 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.629 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.78 -41.67 82.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.641 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.402 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.4 mm-40 -59.8 -46.38 89.4 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.419 -0.512 . . . . 0.0 109.658 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.66 -45.52 73.87 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.98 0.419 . . . . 0.0 110.531 -175.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.96 -45.49 92.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.204 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -58.99 -44.26 91.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.001 0.429 . . . . 0.0 110.8 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.499 ' CB ' HD13 ' A' ' 155' ' ' LEU . 60.7 m-85 -57.47 -46.79 83.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 0.0 110.063 -178.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -58.19 -46.65 85.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.521 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 41.3 mt -58.28 -43.76 88.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.564 -177.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 18.3 mt -61.45 -41.05 96.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.983 -176.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.454 HD11 ' O ' ' A' ' 155' ' ' LEU . 19.6 mt -64.92 -46.03 83.35 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.716 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.4 -39.76 84.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.133 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 67.5 m -85.27 16.32 3.72 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -176.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 62.16 50.66 3.85 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.488 0.661 . . . . 0.0 110.731 176.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -124.89 49.57 3.35 Favored Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.375 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.486 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.2 Cg_endo -57.04 -40.43 83.87 Favored 'Trans proline' 0 N--CA 1.497 1.687 0 C-N-CA 121.168 1.245 . . . . 0.0 111.691 -175.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.66 -37.41 68.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.024 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -68.81 -42.1 77.74 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.974 0.416 . . . . 0.0 110.135 -178.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.13 -41.82 61.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.269 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 62.0 t -65.26 -53.23 42.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.514 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 m -54.45 -38.42 66.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 111.238 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.2 ttt85 -73.08 -53.27 11.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.535 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -57.37 -30.33 64.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.733 -176.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 -76.79 -12.79 60.03 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -177.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 31.4 m -85.66 106.98 10.81 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 118.69 -0.671 . . . . 0.0 110.241 179.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.43 -14.17 19.58 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.209 1.273 . . . . 0.0 113.613 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.95 -23.76 76.83 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.772 -177.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -98.37 140.73 17.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 117.53 0.665 . . . . 0.0 110.377 -176.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.402 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -62.08 156.06 22.47 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.619 0.723 . . . . 0.0 111.719 -177.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.8 p -144.88 137.86 26.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.505 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.6 p -126.06 165.06 29.66 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.386 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.93 -44.63 18.43 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.476 1.451 . . . . 0.0 112.476 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -58.34 -44.8 88.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.948 0.404 . . . . 0.0 110.3 177.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . 0.421 ' HA ' HD12 ' A' ' 155' ' ' LEU . 74.9 m -58.79 -42.15 88.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.476 -179.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . 0.462 ' CB ' HD21 ' A' ' 176' ' ' LEU . 23.1 mtp -58.82 -45.09 90.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.546 -177.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -58.56 -45.48 88.91 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.206 0.526 . . . . 0.0 110.19 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.499 HD13 ' CB ' ' A' ' 125' ' ' TYR . 35.1 mt -58.16 -43.19 87.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.284 0.564 . . . . 0.0 110.288 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.405 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.4 t80 -57.9 -45.31 86.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.362 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -57.72 -45.16 86.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.456 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -58.63 -46.12 87.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.463 -178.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.93 -43.64 91.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.434 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.486 HD22 ' OE1' ' A' ' 168' ' ' GLU . 93.3 mt -56.36 -43.58 79.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.581 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -59.71 -46.1 90.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.239 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 34.8 mtp180 -56.34 -40.89 75.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.222 -177.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.486 HG23 ' HB2' ' A' ' 134' ' ' PRO . 40.8 pt -88.28 13.99 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 -174.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 75.58 19.79 78.93 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 121.382 -0.437 . . . . 0.0 113.347 174.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.405 ' HD2' HD11 ' A' ' 163' ' ' ILE . 94.3 mtt180 -97.08 85.97 3.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.645 0.723 . . . . 0.0 110.124 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -69.99 -46.95 64.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.396 -176.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 23.1 m -55.96 -51.06 69.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.769 0.319 . . . . 0.0 111.173 -175.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.486 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.6 mt-10 -58.93 -40.5 84.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.933 -177.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.24 -47.51 84.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.873 0.368 . . . . 0.0 110.747 -177.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -55.46 -45.55 76.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.001 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.93 -49.89 75.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.26 -179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 53.8 t -57.02 -49.35 79.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 C-N-CA 120.961 -0.295 . . . . 0.0 110.641 -178.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -54.32 -50.04 68.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.31 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -57.36 -40.43 78.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.791 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -61.42 -37.47 83.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.192 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.462 HD21 ' CB ' ' A' ' 153' ' ' MET . 25.1 mt -73.84 144.34 45.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.885 0.374 . . . . 0.0 110.868 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -121.48 145.86 47.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.363 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -56.9 110.57 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.732 -179.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 25.9 m80 -144.03 154.6 43.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.61 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -105.97 117.66 34.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.478 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -81.47 -41.71 21.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.623 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -102.95 139.04 39.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.577 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.597 179.783 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 54.5 ttp . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 11.7 p -135.2 141.87 41.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.384 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.33 142.23 54.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.58 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.5 m -132.73 151.01 33.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.407 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.9 t -82.06 125.3 30.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.653 -179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -61.06 -32.29 71.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.746 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.89 77.64 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.133 -177.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 89.8 mtp -55.71 -50.53 70.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.948 0.404 . . . . 0.0 111.045 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.5 mt -55.57 -47.16 76.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.009 -178.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.69 -49.06 79.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.529 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.6 m -54.08 -52.69 60.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.871 0.367 . . . . 0.0 111.265 -178.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 33.6 mmt180 -57.28 -45.16 84.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.885 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -59.87 -40.2 87.82 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.548 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 58.0 tp60 -58.61 -45.58 88.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.817 0.341 . . . . 0.0 110.308 -178.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -60.35 -46.18 90.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.536 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.62 -48.05 83.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.5 -179.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -59.27 -40.77 87.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.95 -177.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 58.4 tttp -59.29 -46.28 88.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.081 0.467 . . . . 0.0 110.008 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -126.11 108.66 11.55 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.317 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.3 mt -93.47 -11.94 30.87 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -92.31 15.01 14.73 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 17.7 t -108.51 94.72 14.39 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-O 119.247 -0.406 . . . . 0.0 110.255 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -48.73 -34.95 28.97 Favored 'Trans proline' 0 N--CA 1.496 1.67 0 C-N-CA 121.379 1.386 . . . . 0.0 113.067 -175.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.77 -55.06 39.74 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.634 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.65 83.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.638 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 42.7 mm-40 -59.47 -45.9 90.32 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 120.4 -0.52 . . . . 0.0 109.74 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.46 -47.2 73.19 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.127 0.489 . . . . 0.0 110.424 -176.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.23 -45.07 92.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.265 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -58.64 -44.27 90.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.808 -179.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.474 ' CB ' HD13 ' A' ' 155' ' ' LEU . 61.7 m-85 -57.58 -46.75 83.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.272 0.558 . . . . 0.0 110.103 -178.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 29.9 mttp -58.51 -45.93 87.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.683 -178.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 47.5 mt -58.47 -44.37 89.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.529 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.87 -41.28 95.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.994 -176.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.492 HD11 ' O ' ' A' ' 155' ' ' LEU . 23.2 mt -64.68 -46.14 83.67 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.714 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.94 -40.02 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.071 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 68.1 m -85.75 16.57 3.91 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 61.76 51.06 4.02 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.42 0.628 . . . . 0.0 110.697 176.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -124.86 49.6 3.36 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.272 177.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.548 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.8 Cg_endo -56.19 -40.65 83.47 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.225 1.283 . . . . 0.0 111.579 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.46 -38.03 68.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.09 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -68.63 -41.78 78.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.952 0.406 . . . . 0.0 110.188 -178.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.3 t -55.44 -42.39 67.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.235 179.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 52.6 t -65.96 -52.49 48.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.7 m -54.63 -38.33 66.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.801 0.334 . . . . 0.0 111.212 -176.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -73.06 -53.35 11.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.516 -178.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -56.78 -31.58 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -176.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.91 -12.91 60.02 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.5 m -84.69 107.45 11.38 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-O 118.73 -0.653 . . . . 0.0 110.24 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -57.83 -15.83 23.19 Favored 'Trans proline' 0 N--CA 1.501 1.929 0 C-N-CA 121.238 1.292 . . . . 0.0 113.554 -174.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.08 -22.16 77.18 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 121.249 -0.501 . . . . 0.0 112.868 -177.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.0 mt -100.24 139.44 21.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-N 117.646 0.723 . . . . 0.0 110.266 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.09 156.07 18.94 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.571 0.701 . . . . 0.0 111.861 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.7 p -144.77 137.89 26.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.394 176.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.8 p -126.03 164.99 30.02 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.547 177.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -45.86 -44.84 17.94 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.506 1.471 . . . . 0.0 112.533 179.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.29 -44.03 88.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.981 0.419 . . . . 0.0 110.376 177.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 85.7 m -59.17 -41.76 89.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.489 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.33 -45.67 87.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.412 -177.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.49 ' HG2' HD13 ' A' ' 176' ' ' LEU . 93.5 mt-10 -58.53 -45.4 88.95 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.127 0.489 . . . . 0.0 110.238 -179.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.492 ' O ' HD11 ' A' ' 129' ' ' LEU . 45.0 mt -58.41 -42.67 87.71 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.347 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -58.12 -45.69 86.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.124 0.488 . . . . 0.0 110.354 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 63.8 ttp -57.06 -44.35 82.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.497 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -58.99 -49.06 79.34 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.229 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.56 83.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.566 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.81 -43.23 80.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.958 0.408 . . . . 0.0 110.403 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -59.89 -44.71 94.07 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.281 177.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 47.6 mtt180 -55.48 -43.09 75.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.068 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.548 HG23 ' HB2' ' A' ' 134' ' ' PRO . 31.4 pt -89.24 14.14 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 -174.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.93 25.59 68.92 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 121.238 -0.506 . . . . 0.0 113.116 173.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.45 ' NE ' HD12 ' A' ' 163' ' ' ILE . 88.3 mtt180 -97.06 86.08 3.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 117.353 0.577 . . . . 0.0 110.05 175.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -67.17 -52.0 46.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.377 -176.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.4 m -55.92 -51.08 68.9 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.258 -175.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.83 -41.26 90.93 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.957 -177.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.42 -46.73 87.22 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.699 -176.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -56.01 -45.89 78.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.849 0.357 . . . . 0.0 110.937 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.87 -49.68 75.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.323 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 46.2 t -60.58 -47.51 92.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.71 0.291 . . . . 0.0 110.748 -178.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -53.74 -47.1 70.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.405 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -55.91 -39.21 71.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.037 -179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -60.19 -41.34 92.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 110.719 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . 0.49 HD13 ' HG2' ' A' ' 154' ' ' GLU . 79.3 mt -69.68 -35.37 75.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.506 -179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -54.37 -37.54 65.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.3 -178.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -62.01 134.04 56.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.78 0.324 . . . . 0.0 110.507 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -69.04 160.37 31.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.526 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 33.4 t60 -90.36 123.73 34.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.474 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -56.67 -40.53 75.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.823 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -84.39 136.1 34.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.652 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 . . . . . 0 C--O 1.219 -0.538 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.511 179.937 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -108.05 127.82 63.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.022 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -83.93 146.54 27.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.53 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.9 t -101.31 126.5 55.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.961 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 53.4 p -93.99 159.23 15.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.624 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -57.53 -36.24 71.35 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.23 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.01 -40.72 85.82 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.75 0.31 . . . . 0.0 110.766 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.6 mtp -56.95 -45.81 82.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.873 0.368 . . . . 0.0 110.648 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.53 -46.48 80.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.802 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.3 -49.02 79.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.296 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.6 m -53.67 -53.33 53.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.009 0.433 . . . . 0.0 111.357 -178.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -56.72 -43.75 80.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.997 -178.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.26 -40.44 90.33 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.61 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -57.99 -43.76 86.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.898 0.38 . . . . 0.0 110.398 -178.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -60.59 -47.81 84.53 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.482 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.26 -45.85 90.1 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.671 -178.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.26 -42.32 90.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.863 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 39.0 tttp -58.95 -46.02 89.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.06 0.457 . . . . 0.0 110.036 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -127.68 110.39 12.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.381 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 95.8 mt -95.3 -11.91 27.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 178.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.08 15.01 14.3 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 14.9 t -108.67 94.87 15.02 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 119.195 -0.431 . . . . 0.0 110.295 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -48.77 -34.4 27.65 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.402 1.401 . . . . 0.0 113.038 -175.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.79 -55.67 31.89 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.683 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.7 83.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.579 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.408 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 41.9 mm-40 -59.68 -45.8 90.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.739 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.64 75.08 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.963 0.411 . . . . 0.0 110.481 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.39 -44.55 92.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.285 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -59.04 -44.87 91.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.025 0.44 . . . . 0.0 110.926 -178.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.48 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.6 m-85 -57.7 -46.66 84.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.341 0.591 . . . . 0.0 110.099 -178.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.7 mttp -58.48 -45.96 87.59 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.659 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 40.4 mt -58.21 -44.38 88.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.596 -178.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 20.0 mt -60.86 -40.88 94.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.924 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.466 HD12 HD22 ' A' ' 155' ' ' LEU . 15.2 mt -64.42 -46.1 84.69 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.67 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -58.92 -39.93 83.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.746 0.308 . . . . 0.0 111.08 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 75.7 m -85.05 14.91 4.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -176.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 28.8 t30 62.53 50.56 3.55 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.499 0.666 . . . . 0.0 110.808 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -124.97 49.81 3.59 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.204 177.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.514 ' HB2' HG23 ' A' ' 163' ' ' ILE . 17.9 Cg_endo -56.96 -39.12 93.77 Favored 'Trans proline' 0 N--CA 1.497 1.697 0 C-N-CA 121.159 1.239 . . . . 0.0 111.605 -175.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -55.88 -38.07 69.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.05 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -68.41 -42.18 79.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.938 0.399 . . . . 0.0 110.059 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.5 t -55.77 -42.89 71.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.187 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 47.9 t -65.83 -51.94 55.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.617 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.1 t -54.84 -38.7 67.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.931 0.396 . . . . 0.0 111.183 -176.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -72.42 -53.12 13.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.551 -178.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -56.55 -32.15 64.85 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.683 -176.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -76.88 -11.91 59.89 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.356 0.872 . . . . 0.0 113.356 -177.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 23.4 m -85.28 107.22 11.24 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 118.611 -0.709 . . . . 0.0 110.292 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -57.98 -15.22 21.47 Favored 'Trans proline' 0 N--CA 1.501 1.925 0 C-N-CA 121.298 1.332 . . . . 0.0 113.502 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.0 -22.88 77.28 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 121.279 -0.486 . . . . 0.0 112.858 -177.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.3 mt -99.83 141.14 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 117.514 0.657 . . . . 0.0 110.282 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.408 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.58 156.07 20.65 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.624 0.726 . . . . 0.0 111.689 -176.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 59.9 p -142.8 137.91 30.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.454 176.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 96.7 p -125.97 163.34 40.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.406 177.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.13 -45.22 18.43 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 121.459 1.439 . . . . 0.0 112.454 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.44 -43.48 88.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.251 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.1 m -59.69 -41.36 90.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.562 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.7 mtp -58.1 -45.16 87.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.999 0.428 . . . . 0.0 110.429 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -58.81 -45.27 90.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.224 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.48 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.7 mt -58.97 -41.77 88.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.562 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.534 ' CE2' HD11 ' A' ' 160' ' ' LEU . 49.4 t80 -58.8 -45.99 88.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.184 0.516 . . . . 0.0 110.347 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.497 ' HB2' HG11 ' A' ' 172' ' ' VAL . 64.1 ttp -57.68 -46.01 84.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.39 -179.204 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.41 -45.23 88.78 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.503 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.4 -44.49 92.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.436 -178.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.534 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.4 mt -56.09 -42.31 76.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.694 -178.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -60.24 -46.17 90.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.231 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 32.3 mtp85 -56.43 -41.39 76.32 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.216 -177.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.514 HG23 ' HB2' ' A' ' 134' ' ' PRO . 37.2 pt -88.18 14.02 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -175.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 68.36 24.67 74.95 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 121.498 -0.382 . . . . 0.0 113.06 173.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 45.1 mtp85 -97.12 86.99 4.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 117.485 0.642 . . . . 0.0 110.056 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -65.89 -45.59 81.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.641 -175.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 21.8 m -55.93 -51.14 68.69 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.339 -174.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.448 ' OE1' HD22 ' A' ' 160' ' ' LEU . 88.4 mt-10 -62.8 -38.27 90.03 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.101 -176.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.96 -46.96 87.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.876 0.37 . . . . 0.0 110.445 -178.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -55.87 -45.05 78.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.918 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.85 -48.0 81.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.029 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.497 HG11 ' HB2' ' A' ' 157' ' ' MET . 48.8 t -58.31 -45.18 89.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.522 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -53.01 -49.2 66.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.674 0.273 . . . . 0.0 111.498 -179.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -55.84 -39.92 72.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.957 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -65.33 -36.67 84.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.178 178.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 41.5 mt -96.92 108.81 21.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.831 0.348 . . . . 0.0 110.72 -177.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -146.18 -71.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.287 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 76.9 m80 -150.08 -65.56 0.21 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.878 0.37 . . . . 0.0 110.297 178.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -138.42 168.95 18.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.212 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -56.83 146.42 26.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.795 0.331 . . . . 0.0 110.697 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -56.85 -40.81 76.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.741 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -86.61 131.01 34.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.587 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.976 -1.012 . . . . 0.0 110.535 -179.832 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 97.5 mmm . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 27.4 m -79.29 -37.29 18.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.139 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -80.76 129.95 34.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.783 0.325 . . . . 0.0 110.801 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.2 t -134.4 137.78 50.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.908 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 44.9 t -79.31 136.63 37.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.0 p-80 -67.56 -35.46 79.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.391 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.98 -41.23 87.1 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.746 0.307 . . . . 0.0 110.692 -178.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 90.5 mtp -56.46 -44.47 80.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.773 0.32 . . . . 0.0 110.758 -179.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 127' ' ' LEU . 13.7 mt -53.53 -52.11 60.72 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.116 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.46 -49.01 73.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.716 -174.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.6 m -54.17 -54.08 44.7 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.904 -0.319 . . . . 0.0 111.583 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.599 ' HD2' HD11 ' A' ' 127' ' ' LEU . 77.8 mtt-85 -63.93 -37.05 85.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.942 -177.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -61.26 -40.14 92.97 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.468 178.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -59.31 -45.58 90.92 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.19 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -59.95 -45.2 93.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.542 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.32 -47.7 84.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.62 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -58.96 -41.55 87.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.969 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -59.76 -47.16 86.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.073 0.464 . . . . 0.0 110.024 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -125.74 111.12 14.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.366 177.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.7 mt -94.64 -11.99 28.24 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 178.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -91.71 15.06 13.52 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.3 t -107.81 94.89 13.23 Favored Pre-proline 0 CA--C 1.533 0.327 0 CA-C-O 119.187 -0.435 . . . . 0.0 110.295 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -48.92 -37.22 36.28 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 121.363 1.375 . . . . 0.0 113.113 -174.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -57.27 -53.79 54.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 0.0 110.675 -179.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.19 -42.68 86.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.598 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.46 -45.15 92.44 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 120.342 -0.543 . . . . 0.0 109.77 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.55 -47.08 73.64 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.937 0.398 . . . . 0.0 110.477 -176.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.02 -44.54 91.74 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.338 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -59.71 -43.66 94.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.01 0.433 . . . . 0.0 110.863 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.473 ' CB ' HD13 ' A' ' 155' ' ' LEU . 62.6 m-85 -57.64 -46.49 84.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.321 0.581 . . . . 0.0 110.018 -179.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 58.9 mttt -58.89 -42.95 90.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.758 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.599 HD11 ' HD2' ' A' ' 107' ' ' ARG . 14.1 mt -58.26 -48.15 81.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.891 0.377 . . . . 0.0 110.35 -179.317 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 25.8 mt -59.39 -40.19 85.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.592 HD12 HD22 ' A' ' 155' ' ' LEU . 23.9 mt -65.37 -46.13 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.832 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -59.02 -39.14 81.0 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.969 -177.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.1 m -87.61 17.34 4.71 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 31.2 t30 62.15 50.56 3.91 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.431 0.634 . . . . 0.0 110.883 176.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -124.86 49.45 3.23 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.544 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.34 -39.69 89.65 Favored 'Trans proline' 0 N--CA 1.498 1.767 0 C-N-CA 121.236 1.291 . . . . 0.0 111.707 -176.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -56.36 -38.46 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.016 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -67.98 -41.97 81.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.412 . . . . 0.0 110.126 -178.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 61.8 t -55.95 -43.53 75.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.185 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.2 t -65.1 -51.99 58.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.539 -177.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 t -55.29 -39.41 69.85 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.945 0.403 . . . . 0.0 111.135 -176.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -71.66 -51.7 21.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.573 -178.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -57.14 -33.06 67.0 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.004 -0.279 . . . . 0.0 111.649 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -76.96 -10.2 59.21 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 4.6 m -84.2 107.54 11.17 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.708 -0.663 . . . . 0.0 110.223 179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.74 -17.39 29.12 Favored 'Trans proline' 0 N--CA 1.501 1.956 0 C-N-CA 121.237 1.291 . . . . 0.0 113.478 -174.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.91 -21.65 76.8 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.01 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.2 mt -101.08 140.3 20.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 117.58 0.69 . . . . 0.0 110.355 -176.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.61 156.11 24.19 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.767 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 60.3 p -142.8 137.85 29.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.381 176.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.5 p -125.96 165.11 29.17 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.457 177.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.96 -44.58 18.63 Favored 'Trans proline' 0 N--CA 1.499 1.807 0 C-N-CA 121.416 1.411 . . . . 0.0 112.482 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -58.51 -44.36 89.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.273 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 69.0 m -59.43 -41.91 90.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.943 0.401 . . . . 0.0 110.523 -179.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.4 mtp -58.15 -45.35 87.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.358 -177.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -58.8 -45.9 88.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.206 0.527 . . . . 0.0 110.235 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.592 HD22 HD12 ' A' ' 129' ' ' LEU . 34.5 mt -59.09 -41.33 87.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.556 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.569 ' CE2' HD11 ' A' ' 160' ' ' LEU . 52.2 t80 -58.16 -46.56 85.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.178 0.513 . . . . 0.0 110.149 179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.8 ttp -57.72 -43.99 85.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.496 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -58.78 -46.58 87.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.553 -178.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.98 -44.36 91.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.007 0.432 . . . . 0.0 110.352 -178.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.569 HD11 ' CE2' ' A' ' 156' ' ' TYR . 95.7 mt -56.78 -43.16 80.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.565 -178.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.22 -46.15 89.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.178 179.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.6 mtp85 -56.19 -42.35 77.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.206 -176.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.428 HD12 ' NE ' ' A' ' 165' ' ' ARG . 37.7 pt -89.47 14.07 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -174.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 76.92 23.13 70.03 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.282 172.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.428 ' NE ' HD12 ' A' ' 163' ' ' ILE . 88.3 mtt180 -97.12 88.13 4.4 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 117.516 0.658 . . . . 0.0 110.251 175.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -70.5 -49.01 52.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.32 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 85.2 p -55.95 -51.1 68.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.745 0.307 . . . . 0.0 111.207 -176.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.525 ' OE1' HD22 ' A' ' 160' ' ' LEU . 93.4 mt-10 -59.48 -39.0 82.28 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.904 -0.319 . . . . 0.0 110.97 -177.325 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.34 -47.92 82.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.894 0.378 . . . . 0.0 110.537 -177.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -55.62 -44.78 77.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.896 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.87 -49.91 75.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.247 -179.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.79 -48.11 84.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.984 -0.287 . . . . 0.0 110.605 -178.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -53.54 -49.07 68.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.325 -178.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -56.02 -39.25 71.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.982 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -62.41 -38.78 91.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.98 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 79.9 mt -58.59 -34.15 70.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.554 -179.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -54.76 -38.09 66.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.645 0.26 . . . . 0.0 111.239 -177.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -139.32 132.3 29.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.789 0.328 . . . . 0.0 110.814 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -134.82 154.55 51.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.542 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -106.34 130.24 54.21 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -96.84 -68.56 0.79 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.887 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -110.0 141.13 43.21 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.727 -178.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 C--O 1.219 -0.508 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.599 179.615 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.7 ttm . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -121.42 135.8 60.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.959 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.2 144.46 56.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.665 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 11.6 p -135.81 144.89 32.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.221 179.863 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.0 t -94.04 143.57 26.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.633 -179.605 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -54.62 -35.36 63.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.373 179.861 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.94 77.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.671 0.272 . . . . 0.0 111.033 -178.742 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 97.2 mmm -56.32 -43.99 79.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.851 0.357 . . . . 0.0 110.714 -179.437 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.4 mt -56.2 -48.74 75.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.858 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.64 -49.04 79.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.289 -176.646 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.08 -53.49 49.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.39 -178.554 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.7 -44.74 81.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 -178.825 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -60.14 -39.54 86.69 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.662 -179.18 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -58.06 -45.14 87.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.94 0.4 . . . . 0.0 110.318 -178.774 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -60.4 -47.42 86.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.435 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.09 91.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.668 -178.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -59.35 -43.18 92.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.842 -178.371 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -59.11 -46.32 88.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.09 0.472 . . . . 0.0 110.095 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -125.72 108.88 11.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.33 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.2 mt -95.16 -11.88 27.37 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 178.54 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.8 p -91.82 14.95 14.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 22.2 t -108.25 94.73 13.87 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-O 119.206 -0.426 . . . . 0.0 110.285 178.485 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -48.76 -34.53 27.98 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.411 1.407 . . . . 0.0 113.053 -175.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -58.03 -55.43 35.06 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.593 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.83 83.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.574 -179.042 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.41 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 42.1 mm-40 -59.81 -45.89 90.92 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.665 -178.924 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.68 -46.53 74.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.003 0.43 . . . . 0.0 110.544 -176.297 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.41 -44.82 92.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.307 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 15.4 t80 -59.17 -44.35 92.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.928 0.394 . . . . 0.0 110.834 -178.849 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.489 ' CB ' HD13 ' A' ' 155' ' ' LEU . 65.7 m-85 -57.73 -46.61 84.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.132 -178.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -58.55 -45.93 87.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.676 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.3 -44.51 88.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.542 -178.039 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.6 mt -60.96 -41.06 95.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.859 -176.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.464 HD12 HD22 ' A' ' 155' ' ' LEU . 12.6 mt -63.93 -46.11 86.22 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.611 179.818 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.79 -40.56 84.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.029 -177.677 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 70.7 m -84.85 15.99 3.62 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 61.75 50.86 4.13 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.495 0.664 . . . . 0.0 110.792 177.01 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -124.9 49.15 3.0 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.275 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.52 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.0 Cg_endo -57.51 -39.75 86.19 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 C-N-CA 121.111 1.207 . . . . 0.0 111.765 -174.755 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -55.6 -37.94 68.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.0 -179.65 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -68.48 -41.9 79.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.001 0.429 . . . . 0.0 110.176 -179.075 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 58.8 t -55.36 -42.72 68.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.247 179.249 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 44.8 t -65.57 -52.23 53.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.5 -177.618 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.1 m -54.87 -39.06 68.27 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.883 0.373 . . . . 0.0 111.191 -176.526 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -71.86 -52.72 16.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.592 -178.928 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -56.29 -32.91 65.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -176.228 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -76.81 -12.21 59.94 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.009 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 27.0 m -83.44 107.82 11.21 Favored Pre-proline 0 CA--C 1.535 0.385 0 CA-C-O 118.669 -0.681 . . . . 0.0 110.338 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -57.61 -16.62 25.05 Favored 'Trans proline' 0 N--CA 1.501 1.947 0 C-N-CA 121.249 1.299 . . . . 0.0 113.516 -174.689 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.03 -22.9 77.34 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.842 -177.1 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.7 mt -99.9 140.77 18.32 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 117.567 0.683 . . . . 0.0 110.28 -176.305 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.41 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.51 156.05 20.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.569 0.699 . . . . 0.0 111.749 -176.99 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 61.0 p -142.23 137.89 31.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.405 176.53 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.9 p -126.02 163.23 40.95 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.522 177.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -46.08 -45.26 18.18 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.43 1.42 . . . . 0.0 112.472 178.728 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -58.33 -43.31 88.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.308 177.964 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 63.6 m -59.81 -41.51 91.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.554 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.07 -45.21 87.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.372 -178.28 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -58.73 -45.45 89.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.13 0.491 . . . . 0.0 110.207 179.725 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.489 HD13 ' CB ' ' A' ' 125' ' ' TYR . 40.3 mt -59.03 -40.94 86.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.712 -179.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.537 ' CE2' HD11 ' A' ' 160' ' ' LEU . 57.4 t80 -58.78 -47.24 85.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.127 0.489 . . . . 0.0 110.256 179.779 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 62.2 ttp -57.95 -44.8 87.2 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.42 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.45 -45.15 89.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.538 -178.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.47 -44.54 93.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.049 0.452 . . . . 0.0 110.496 -178.241 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.537 HD11 ' CE2' ' A' ' 156' ' ' TYR . 92.2 mt -56.56 -41.96 77.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.589 -178.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -60.7 -45.78 92.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.445 178.687 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 -56.19 -41.03 74.9 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.178 -177.111 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.52 HG23 ' HB2' ' A' ' 134' ' ' PRO . 36.0 pt -86.48 14.03 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -175.517 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 73.54 20.0 79.77 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 121.502 -0.38 . . . . 0.0 113.182 174.504 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -97.16 86.01 3.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.696 0.748 . . . . 0.0 109.848 177.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -71.81 -47.53 52.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.843 -174.364 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.0 t -55.86 -51.18 68.45 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.499 -173.734 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -64.84 -37.16 86.68 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.986 -176.861 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -60.61 -46.95 88.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.94 0.4 . . . . 0.0 110.3 -178.589 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -56.53 -45.13 81.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.808 179.686 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.83 -48.13 80.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.171 -178.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 47.2 t -59.81 -46.95 93.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.658 0.266 . . . . 0.0 110.662 -179.266 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -53.1 -44.58 67.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.413 -178.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -55.98 -39.41 71.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.899 179.226 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -62.53 -39.87 94.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.76 179.212 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.87 147.52 28.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.52 179.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -126.45 157.69 37.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.586 -179.71 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -108.19 143.11 37.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.55 179.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -111.8 136.71 50.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.583 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -109.17 142.31 40.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.492 179.857 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -56.89 -41.24 77.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.684 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -107.28 141.51 38.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.492 -179.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.6 179.975 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 55.2 ttp . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.5 t -64.91 132.54 30.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.118 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.05 148.86 46.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.577 -179.866 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -95.87 129.24 46.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.95 179.698 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 95.6 p -94.01 136.81 33.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.723 -179.24 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 27.5 p-80 -77.72 -20.18 53.96 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 178.835 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.97 -34.7 72.1 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 122.322 -0.236 . . . . 0.0 111.452 -177.702 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 72.8 mtm -54.93 -51.37 66.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.789 0.328 . . . . 0.0 111.198 -178.017 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 93.8 mt -55.4 -48.01 75.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.96 -178.634 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.43 -49.04 79.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.372 -176.343 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.2 m -53.33 -51.79 61.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.907 0.384 . . . . 0.0 111.344 -178.217 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 25.6 mmt180 -56.8 -46.11 81.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.002 -179.037 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -59.83 -40.01 87.04 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.582 -179.033 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.34 -45.78 87.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.323 -178.482 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -60.29 -46.66 89.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.563 -178.681 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.05 89.52 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.592 -179.511 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 56.2 t-20 -59.05 -43.41 91.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.026 -177.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -60.07 -47.31 86.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.951 0.405 . . . . 0.0 110.133 -179.481 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -121.92 108.85 13.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.383 178.151 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 92.4 mt -95.65 -11.88 26.47 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 178.429 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 80.0 p -92.36 15.07 14.69 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -178.152 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.9 t -109.09 94.79 15.84 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-O 119.237 -0.411 . . . . 0.0 110.208 178.249 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -48.87 -35.19 30.59 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 121.411 1.407 . . . . 0.0 112.92 -175.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -57.77 -54.93 41.33 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.667 -179.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.7 81.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.576 -179.02 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.413 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 44.8 mm-40 -59.82 -47.05 87.29 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.689 -179.191 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.43 -46.34 73.19 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.883 0.373 . . . . 0.0 110.583 -175.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.53 91.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.245 -179.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -58.63 -44.57 90.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.854 -179.15 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.445 ' CB ' HD13 ' A' ' 155' ' ' LEU . 63.2 m-85 -57.71 -46.76 83.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.327 0.584 . . . . 0.0 110.114 -178.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -58.46 -46.41 86.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.678 -178.136 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 44.6 mt -58.67 -44.34 90.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.544 -178.088 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.4 mt -61.4 -40.68 95.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.946 -176.643 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.467 HD11 ' O ' ' A' ' 155' ' ' LEU . 18.6 mt -64.92 -46.14 82.92 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.655 179.879 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -59.45 -39.71 84.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.693 0.283 . . . . 0.0 111.101 -177.792 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 58.3 m -85.64 16.42 3.94 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -176.774 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 58.3 t30 62.18 50.85 3.75 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.464 0.65 . . . . 0.0 110.848 176.705 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -124.95 48.68 2.73 Favored Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.397 177.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.499 ' HB2' HG23 ' A' ' 163' ' ' ILE . 19.1 Cg_endo -57.3 -39.38 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.737 0 C-N-CA 121.133 1.222 . . . . 0.0 111.694 -174.568 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -55.95 -38.18 69.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.021 -179.12 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -69.38 -41.61 76.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.905 0.383 . . . . 0.0 110.016 -179.047 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 59.6 t -55.34 -42.82 68.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.153 179.179 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 46.9 t -66.4 -52.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.646 -177.541 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 85.0 p -54.64 -37.7 65.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.832 0.349 . . . . 0.0 111.205 -176.666 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -72.92 -54.02 9.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.54 -179.077 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.64 -30.91 63.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.838 0.311 . . . . 0.0 111.838 -175.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -76.81 -16.03 59.56 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.959 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 9.2 m -81.25 107.91 9.11 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.218 -179.7 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -57.62 -16.39 24.2 Favored 'Trans proline' 0 N--CA 1.502 1.994 0 C-N-CA 121.13 1.22 . . . . 0.0 113.501 -174.384 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.97 -23.4 77.06 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 121.296 -0.478 . . . . 0.0 112.913 -177.074 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 74.4 mt -98.23 140.73 17.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 117.51 0.655 . . . . 0.0 110.362 -176.076 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.413 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.48 156.05 20.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.637 0.732 . . . . 0.0 111.8 -176.95 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 57.1 p -144.15 137.89 27.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.418 176.237 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 91.2 p -125.55 163.53 38.17 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.259 177.671 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -45.97 -45.11 18.03 Favored 'Trans proline' 0 N--CA 1.498 1.764 0 C-N-CA 121.527 1.485 . . . . 0.0 112.456 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.34 -44.12 88.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.271 177.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . . . . . . . . . 62.4 m -59.53 -41.23 89.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.545 -179.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.04 -45.22 87.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.952 0.406 . . . . 0.0 110.427 -178.069 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -58.73 -45.79 88.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.138 0.494 . . . . 0.0 110.223 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.467 ' O ' HD11 ' A' ' 129' ' ' LEU . 41.6 mt -58.72 -41.64 86.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.536 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.535 ' CE2' HD11 ' A' ' 160' ' ' LEU . 45.5 t80 -58.63 -46.06 87.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.162 0.506 . . . . 0.0 110.375 179.661 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 61.0 ttp -58.08 -44.38 87.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.453 -178.995 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -58.74 -47.01 86.09 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.42 -177.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.79 -43.72 90.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.063 0.458 . . . . 0.0 110.374 -178.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.535 HD11 ' CE2' ' A' ' 156' ' ' TYR . 93.7 mt -56.33 -43.47 79.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.594 -178.655 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.48 -46.47 88.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.228 179.715 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 31.0 mtp85 -56.73 -40.79 76.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.263 -176.896 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.499 HG23 ' HB2' ' A' ' 134' ' ' PRO . 41.0 pt -88.5 14.08 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.118 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 74.71 19.35 79.93 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.423 -0.418 . . . . 0.0 113.371 174.422 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.402 ' HD2' HD11 ' A' ' 163' ' ' ILE . 93.2 mtt180 -97.14 86.08 3.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 117.659 0.73 . . . . 0.0 110.17 176.78 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 46.4 p-80 -70.83 -45.81 63.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.364 -177.097 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 20.0 m -55.95 -51.08 68.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.893 0.378 . . . . 0.0 111.17 -176.518 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.47 ' OE1' HD22 ' A' ' 160' ' ' LEU . 92.8 mt-10 -59.15 -38.98 81.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.981 -177.725 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.21 -47.97 82.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.895 0.379 . . . . 0.0 110.539 -177.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -55.35 -44.99 76.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.966 179.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.86 -49.41 76.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.242 -179.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.402 HG21 ' CE2' ' A' ' 156' ' ' TYR . 50.7 t -57.26 -48.14 82.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.651 -178.769 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 58.8 ttt85 -53.51 -50.06 66.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.348 -178.296 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -57.64 -40.52 79.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.711 179.185 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -56.97 -39.33 74.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.937 -179.691 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 83.4 mt -56.18 -36.52 68.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.182 -179.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -56.05 -46.04 79.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.731 0.301 . . . . 0.0 110.887 -178.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -148.84 144.86 27.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.825 0.345 . . . . 0.0 110.666 -179.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 72.1 m80 -84.12 134.85 34.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.591 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 75.5 m80 -134.14 124.25 25.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.478 179.579 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -60.35 -43.65 96.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.596 179.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -57.17 -41.15 78.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.699 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.559 -179.942 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 85.6 mtp . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.0 t -105.73 132.7 52.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.022 -179.98 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -82.23 151.03 27.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.565 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.7 m -127.49 142.47 43.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.388 179.736 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.0 t -94.05 113.08 24.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.584 -179.721 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -66.73 -36.32 82.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.217 179.367 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.95 -39.26 81.11 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.662 0.267 . . . . 0.0 110.876 -178.452 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . . . . . . . . . 87.9 mtp -56.46 -45.78 80.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 0.0 110.674 -179.658 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.43 -47.06 79.85 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.841 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.07 79.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.187 -176.63 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 29.7 m -53.54 -52.74 58.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.932 0.396 . . . . 0.0 111.341 -178.469 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -56.29 -44.94 80.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.078 -179.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -59.81 -40.25 87.75 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.709 -178.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -58.27 -44.96 88.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.402 . . . . 0.0 110.346 -178.738 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 81.8 mm-40 -60.5 -46.19 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.571 -179.313 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -59.65 -47.32 86.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.523 -179.218 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -59.27 -41.19 88.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -59.35 -46.93 87.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.054 0.454 . . . . 0.0 109.936 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -124.61 106.78 10.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.179 177.289 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 94.1 mt -94.22 -11.86 29.43 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 178.947 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 82.0 p -92.06 14.97 14.38 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.557 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.1 t -109.02 94.84 15.75 Favored Pre-proline 0 CA--C 1.533 0.326 0 O-C-N 122.07 -0.394 . . . . 0.0 110.339 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -48.82 -32.8 23.39 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 121.362 1.374 . . . . 0.0 113.011 -175.279 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -59.23 -55.46 34.62 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.565 -179.987 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.32 82.83 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.604 -179.257 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.416 ' HG3' ' HB3' ' A' ' 147' ' ' ALA . 41.3 mm-40 -59.86 -46.1 90.37 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.396 -0.522 . . . . 0.0 109.693 -179.032 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.9 -46.15 74.79 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.917 0.389 . . . . 0.0 110.484 -176.174 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -59.34 -44.87 92.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.264 179.809 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -59.11 -44.96 92.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.877 -179.192 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 125' ' ' TYR . . . . . 0.507 ' CB ' HD13 ' A' ' 155' ' ' LEU . 64.5 m-85 -57.72 -46.25 84.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.298 0.57 . . . . 0.0 110.09 -178.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -58.19 -47.04 84.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.57 -178.552 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 35.2 mt -58.16 -43.4 87.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.527 -177.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 21.3 mt -61.07 -41.26 96.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.94 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.461 HD12 HD22 ' A' ' 155' ' ' LEU . 14.2 mt -64.59 -46.1 84.14 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.521 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -58.25 -40.82 82.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.014 -177.651 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 72.7 m -85.73 16.11 4.25 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -176.416 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 22.6 m120 61.63 51.63 3.92 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.474 0.654 . . . . 0.0 110.718 176.803 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -124.82 50.39 3.99 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.113 178.032 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.516 ' HB2' HG23 ' A' ' 163' ' ' ILE . 18.7 Cg_endo -56.87 -40.47 83.96 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.184 1.256 . . . . 0.0 111.591 -175.614 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -55.7 -37.15 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.147 -179.667 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -69.04 -42.27 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.938 0.399 . . . . 0.0 110.154 -178.67 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 54.4 t -55.29 -41.88 63.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.249 179.049 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 57.9 t -65.7 -53.37 39.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.536 -178.481 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 84.7 p -54.37 -38.11 65.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.942 0.401 . . . . 0.0 111.283 -176.017 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 54.2 ttt85 -72.97 -53.65 10.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.599 -179.051 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.52 -29.35 64.26 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.028 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -76.89 -14.28 59.9 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.738 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 24.6 m -84.79 107.22 10.66 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.25 179.686 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -58.46 -14.53 21.03 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 121.208 1.272 . . . . 0.0 113.586 -174.384 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -69.92 -23.51 76.94 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.302 -0.475 . . . . 0.0 112.919 -177.633 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 73.5 mt -98.35 139.97 19.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 117.483 0.642 . . . . 0.0 110.297 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.416 ' HB3' ' HG3' ' A' ' 121' ' ' GLN . . . -61.19 156.06 19.33 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.76 -176.746 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 66.4 p -141.84 137.95 31.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.356 176.56 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 78.0 p -125.95 163.5 39.08 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.447 177.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -46.24 -45.64 18.05 Favored 'Trans proline' 0 N--CA 1.499 1.827 0 C-N-CA 121.446 1.431 . . . . 0.0 112.262 178.33 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -58.22 -44.68 88.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.371 177.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 152' ' ' CYS . . . . . 0.405 ' HA ' HD12 ' A' ' 155' ' ' LEU . 59.1 m -59.24 -41.55 88.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.408 . . . . 0.0 110.585 -179.454 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 153' ' ' MET . . . . . . . . . . . . . 23.6 mtp -58.15 -45.18 87.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.434 -177.849 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -59.12 -45.65 90.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.153 0.501 . . . . 0.0 110.322 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.507 HD13 ' CB ' ' A' ' 125' ' ' TYR . 43.0 mt -57.63 -42.89 84.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.425 -179.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.529 ' CZ ' HD11 ' A' ' 160' ' ' LEU . 12.2 t80 -59.54 -47.41 85.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.292 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 157' ' ' MET . . . . . 0.48 ' HA ' HD12 ' A' ' 160' ' ' LEU . 61.3 ttp -56.95 -43.04 81.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.079 0.466 . . . . 0.0 110.638 -177.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -60.08 -49.14 78.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.292 -178.459 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -58.08 -41.29 83.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.0 0.429 . . . . 0.0 110.496 -177.883 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 160' ' ' LEU . . . . . 0.529 HD11 ' CZ ' ' A' ' 156' ' ' TYR . 60.1 mt -57.05 -44.19 82.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.363 -179.077 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -59.55 -44.4 93.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.358 178.37 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 162' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 -55.19 -42.0 72.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.122 -177.417 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.516 HG23 ' HB2' ' A' ' 134' ' ' PRO . 37.3 pt -89.33 14.02 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 77.82 16.53 79.9 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.331 -0.462 . . . . 0.0 113.429 174.434 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -97.04 89.67 4.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 117.765 0.783 . . . . 0.0 110.047 176.896 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 32.9 p80 -76.48 -42.33 44.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.618 -175.29 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 13.2 t -55.92 -51.15 68.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 0.0 111.204 -175.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -60.96 -39.5 89.77 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.855 -177.477 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.16 -46.88 87.01 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.662 -177.325 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -55.8 -45.72 78.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.848 0.356 . . . . 0.0 110.94 -179.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.52 76.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.243 -179.075 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 47.6 t -59.17 -45.96 92.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.659 0.266 . . . . 0.0 110.597 -178.621 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 173' ' ' ARG . . . . . . . . . . . . . 56.6 ttt85 -53.32 -50.0 65.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.353 -178.258 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 174' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -55.91 -40.01 72.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.931 179.369 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -64.23 -35.47 80.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.34 179.597 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 176' ' ' LEU . . . . . . . . . . . . . 83.3 mt -89.33 39.91 0.96 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.068 0.461 . . . . 0.0 110.94 -178.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -57.19 -35.57 69.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.322 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 178' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -54.47 -38.96 67.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.704 0.288 . . . . 0.0 111.212 -178.359 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 179' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -96.45 136.9 36.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.618 -179.553 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -102.92 130.45 49.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.515 -179.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -91.32 -40.52 11.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.701 179.77 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 79.5 m80 -130.99 143.59 50.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.483 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 . . . . . 0 C--O 1.221 -0.435 0 CA-C-O 117.887 -1.054 . . . . 0.0 110.573 179.787 . . . . . . . . 0 0 . 1 stop_ save_