data_1xrd_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 1xrd _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.845 0.355 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.23 -46.52 83.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.017 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.6 mt -66.86 -35.69 80.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.271 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.3 t -70.54 -27.36 30.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.535 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.68 -49.13 11.29 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.098 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.61 -57.77 9.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.566 0.698 . . . . 0.0 109.862 179.392 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.51 -48.67 68.79 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.745 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.413 ' O ' HG23 ' A' ' 23' ' ' VAL . 93.2 m -68.29 -37.55 80.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.513 ' O ' HG23 ' A' ' 23' ' ' VAL . 38.7 t80 -60.11 -52.68 64.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.355 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.4 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 3.5 pp -66.51 -49.15 67.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.909 0.385 . . . . 0.0 110.804 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.4 ' N ' ' CD1' ' A' ' 21' ' ' LEU . 7.7 t80 -54.18 -49.23 69.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.767 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 20' ' ' PHE . 22.1 m -65.76 -48.56 81.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.618 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.407 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.3 OUTLIER -52.35 -65.04 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.98 0.419 . . . . 0.0 111.373 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.64 -31.74 66.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.182 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.3 mt -63.99 -49.44 72.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.644 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mt -62.83 -37.89 88.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.914 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 14.6 mt -63.12 -62.88 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.124 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.559 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 3.2 m170 -59.94 -38.6 82.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.032 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.442 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 25.6 t80 -64.66 -45.25 87.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.732 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.472 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.8 OUTLIER -68.71 -47.61 75.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.407 -179.591 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.472 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 4.3 pp -65.97 -47.71 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.936 0.398 . . . . 0.0 110.305 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.559 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.6 OUTLIER -61.9 -45.47 93.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.401 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.6 t -62.09 -55.27 30.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.414 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.1 m -62.43 -39.58 93.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -64.61 -57.69 8.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.24 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -37.41 87.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.143 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.48 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 85.9 t80 -61.49 -66.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.552 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.0 t-20 -57.84 -20.44 36.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.233 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -68.68 -70.68 0.25 Allowed 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -63.44 -17.34 62.59 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.552 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 46.0 tp10 . . . . . 0 N--CA 1.45 -0.466 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.539 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.791 0.329 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.458 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -63.6 -49.15 74.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.941 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.06 -36.15 82.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.285 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.1 t -67.83 -27.61 38.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.081 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.12 -42.53 35.94 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.829 -0.7 . . . . 0.0 111.55 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.7 -61.49 2.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.24 0.543 . . . . 0.0 110.368 179.25 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.56 74.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.897 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.409 ' O ' HG22 ' A' ' 23' ' ' VAL . 96.4 m -68.09 -42.68 79.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.718 0.294 . . . . 0.0 111.212 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.485 ' O ' HG22 ' A' ' 23' ' ' VAL . 28.3 t80 -60.75 -49.37 77.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.48 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.403 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 3.2 pp -65.71 -50.66 64.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.858 0.361 . . . . 0.0 110.848 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.403 ' N ' ' CD1' ' A' ' 21' ' ' LEU . 2.0 t80 -55.48 -49.98 71.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.66 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 20' ' ' PHE . 22.3 m -63.4 -50.61 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.41 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.0 OUTLIER -59.46 -34.74 72.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.983 0.421 . . . . 0.0 110.18 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.06 -53.57 53.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.954 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 23' ' ' VAL . 1.3 pp -62.94 -33.62 75.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.82 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.421 HD21 ' HG ' ' A' ' 26' ' ' LEU . 2.0 mm? -62.66 -48.41 79.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.831 0.348 . . . . 0.0 110.701 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 9.2 mt -63.45 -54.32 34.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.159 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.548 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 t60 -58.98 -40.05 83.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.994 0.426 . . . . 0.0 110.81 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.479 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 24.0 t80 -65.09 -44.48 88.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.5 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.475 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 2.5 tp -68.59 -47.88 74.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.081 -0.247 . . . . 0.0 111.294 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.475 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 4.3 pp -65.49 -48.72 71.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.851 0.358 . . . . 0.0 110.173 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.548 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.5 OUTLIER -61.31 -41.71 97.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.206 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -62.79 -59.53 4.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.15 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.0 m -59.51 -48.18 82.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.505 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 2.6 pp20? -62.13 -43.52 98.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -66.58 -36.84 83.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.047 0.451 . . . . 0.0 110.473 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.503 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 10.7 t80 -61.81 -65.74 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.711 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.483 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 58.4 m-80 -57.63 -22.05 43.21 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.986 0.422 . . . . 0.0 111.13 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -67.44 -70.57 0.25 Allowed 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 pp -64.41 -14.84 58.87 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.031 177.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.503 ' HB2' ' O ' ' A' ' 38' ' ' PHE . 2.2 tt0 . . . . . 0 N--CA 1.45 -0.464 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.508 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.418 ' HA ' HG11 ' A' ' 15' ' ' VAL . 4.1 pp0? . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.933 0.396 . . . . 0.0 111.465 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.87 -36.14 78.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.769 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.422 ' HG ' ' N ' ' A' ' 15' ' ' VAL . 0.6 OUTLIER -72.23 -41.34 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.619 0.247 . . . . 0.0 111.056 -179.654 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.422 ' N ' ' HG ' ' A' ' 14' ' ' LEU . 7.2 p -70.25 -26.57 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.592 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.76 -54.82 5.7 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.881 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.403 ' CD1' ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -63.12 -49.19 75.39 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.979 0.419 . . . . 0.0 110.91 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.403 ' N ' ' CD1' ' A' ' 17' ' ' LEU . . . -59.59 -47.34 85.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.746 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.406 ' O ' HG22 ' A' ' 23' ' ' VAL . 81.7 m -66.6 -50.6 62.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.39 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.464 ' O ' HG22 ' A' ' 23' ' ' VAL . 69.5 t80 -59.92 -44.51 94.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.738 0.304 . . . . 0.0 111.283 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.17 -54.81 17.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.967 0.413 . . . . 0.0 110.704 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.82 -48.21 70.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.799 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 20' ' ' PHE . 22.7 m -64.12 -49.31 81.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 111.661 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.415 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -58.27 -57.92 10.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.012 0.434 . . . . 0.0 111.265 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.5 73.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.815 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.81 -37.35 84.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 0.0 110.891 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.417 ' O ' ' CD1' ' A' ' 30' ' ' PHE . 1.9 mp -60.05 -56.52 20.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.604 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.0 mm -63.4 -28.7 45.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.809 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.412 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.9 t-80 -62.79 -65.09 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.245 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 27' ' ' LEU . 2.3 p90 -62.43 -31.61 72.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.561 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.511 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.5 tp -69.59 -51.69 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.911 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.511 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 2.0 pp -64.29 -41.39 96.9 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.9 mt -60.32 -59.06 6.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.589 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.403 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 2.4 t -59.98 -28.11 67.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.189 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 m -66.09 -52.69 46.41 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.977 0.418 . . . . 0.0 110.536 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -62.41 -45.14 94.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.624 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.9 mmt-85 -64.74 -36.23 83.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.504 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.525 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.9 m-85 -61.21 -66.35 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.386 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.554 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 11.9 m-80 -59.81 -18.77 46.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.845 0.355 . . . . 0.0 111.16 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 72.8 t-105 -68.11 -74.91 0.11 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.793 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.428 ' CD1' ' O ' ' A' ' 38' ' ' PHE . 0.0 OUTLIER -63.19 -15.21 56.2 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.183 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.554 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 4.7 tt0 . . . . . 0 N--CA 1.451 -0.409 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.291 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.84 0.352 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.478 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.11 -40.25 94.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.33 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.3 mt -66.02 -43.6 87.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.608 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m -69.28 -22.01 25.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.624 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.41 -50.13 10.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.772 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -63.91 -55.73 20.49 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.643 0.735 . . . . 0.0 109.558 178.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.13 -38.28 65.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.528 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.416 ' O ' HG22 ' A' ' 23' ' ' VAL . 4.5 m -67.61 -42.87 81.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.828 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.519 ' O ' HG22 ' A' ' 23' ' ' VAL . 18.4 t80 -60.76 -51.84 67.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.089 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.6 pp -66.31 -47.73 72.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.611 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -55.71 -48.61 74.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.766 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 20' ' ' PHE . 25.3 m -65.24 -49.03 81.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.814 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.16 -44.81 92.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.913 0.387 . . . . 0.0 110.569 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.18 -56.82 16.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.238 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.84 -28.67 70.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.752 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.48 -60.43 3.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.736 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 5.1 mt -62.77 -44.98 99.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.942 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.611 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 39.8 m170 -60.23 -42.56 95.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.444 ' O ' HD22 ' A' ' 33' ' ' LEU . 19.5 t80 -64.63 -38.38 90.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.591 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.469 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -70.38 -47.83 63.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.03 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.469 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 3.3 pp -65.23 -51.51 60.49 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.611 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -59.4 -40.08 85.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.272 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.453 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 27.4 t -61.51 -49.99 74.52 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.58 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.4 m -59.39 -44.17 92.84 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.63 -49.6 74.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -64.9 -32.31 73.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.486 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.495 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.7 m-85 -62.19 -63.97 1.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.442 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.489 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-80 -58.67 -21.68 54.91 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 110.983 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -70.49 0.25 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.12 -15.41 56.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' A' ' 38' ' ' PHE . 13.3 tp10 . . . . . 0 N--CA 1.451 -0.412 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.709 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.974 0.416 . . . . 0.0 110.979 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.11 70.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.08 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.1 mt -69.94 -44.8 68.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.767 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.6 p -68.91 -27.08 34.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -73.48 -55.27 6.18 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.746 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.402 ' CD1' ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -61.69 -47.88 83.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.062 0.458 . . . . 0.0 110.51 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.402 ' N ' ' CD1' ' A' ' 17' ' ' LEU . . . -58.42 -37.51 75.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.369 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.0 m -67.08 -55.3 14.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.028 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.452 ' O ' HG23 ' A' ' 23' ' ' VAL . 4.0 t80 -59.63 -44.33 93.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.334 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.467 ' CD2' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.03 -57.77 6.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.467 ' N ' ' CD2' ' A' ' 21' ' ' LEU . 72.5 t80 -50.63 -49.12 57.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.77 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 20' ' ' PHE . 19.4 m -64.16 -50.28 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.737 0.303 . . . . 0.0 111.525 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.429 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 10.5 tp -52.83 -65.28 0.59 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 111.072 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.63 -22.93 25.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.576 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -66.34 -53.44 36.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 179.152 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.11 -46.9 85.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 110.551 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.443 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 39.3 mm -63.6 -61.33 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.968 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.435 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 25.1 t-80 -55.11 -43.18 73.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.218 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.453 ' O ' HD22 ' A' ' 33' ' ' LEU . 57.0 t80 -61.52 -31.56 71.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.057 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.453 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.4 tt -72.87 -47.23 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.827 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.453 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 4.1 mt -64.75 -54.24 34.57 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.15 0.5 . . . . 0.0 110.017 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.453 HD22 ' O ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -56.35 -39.02 72.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.957 179.449 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.422 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 3.6 m -60.72 -51.04 71.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.0 m -62.82 -38.1 89.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.747 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -63.83 -45.7 88.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.706 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -36.82 85.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.452 . . . . 0.0 110.39 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.425 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.6 m-85 -61.4 -64.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.591 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 11.4 m-20 -60.77 -18.1 52.99 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.234 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -69.75 -73.68 0.15 Allowed 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.757 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.76 -16.71 58.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.195 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 6.7 mm-40 . . . . . 0 N--CA 1.45 -0.474 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.675 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.792 0.33 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.485 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.19 -46.08 85.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.113 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.13 -34.23 77.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.404 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.3 t -68.21 -28.72 41.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.149 179.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.34 -43.41 31.48 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.617 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.3 -61.04 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.236 0.541 . . . . 0.0 110.424 179.416 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.86 -47.83 76.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.075 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 89.7 m -66.0 -51.24 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.685 0.279 . . . . 0.0 111.29 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.409 ' O ' HG22 ' A' ' 23' ' ' VAL . 12.9 t80 -59.61 -35.53 74.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.456 ' CD2' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.78 -61.26 1.96 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.678 179.655 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.456 ' N ' ' CD2' ' A' ' 21' ' ' LEU . 25.7 t80 -54.02 -44.22 70.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.986 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.409 HG22 ' O ' ' A' ' 20' ' ' PHE . 29.2 m -65.2 -49.21 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.49 -45.25 94.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.893 0.378 . . . . 0.0 110.719 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.99 -39.75 86.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.794 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.415 HD11 ' CE2' ' A' ' 22' ' ' PHE . 23.1 mt -64.38 -41.57 96.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.736 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.09 -57.46 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.077 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.48 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 2.2 pp -60.75 -50.98 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.201 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.483 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 32.4 t-80 -56.78 -38.1 72.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.909 0.385 . . . . 0.0 110.456 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.488 ' O ' HD22 ' A' ' 33' ' ' LEU . 43.5 t80 -64.7 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.892 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.435 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -71.24 -45.59 69.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.82 0.343 . . . . 0.0 110.651 179.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 28' ' ' ILE . 3.7 mt -65.67 -53.99 33.68 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.08 0.467 . . . . 0.0 110.091 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -57.81 -40.99 81.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.228 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.459 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 65.2 p -62.66 -49.79 73.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.722 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.9 m -61.77 -41.07 97.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.112 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.71 -53.22 54.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.92 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -63.85 -35.03 79.29 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.597 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.448 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 51.2 t80 -60.02 -66.3 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.429 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.612 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 13.4 m-80 -59.67 -17.55 34.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.034 0.445 . . . . 0.0 111.033 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -68.27 -75.98 0.1 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.819 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.92 -16.18 58.15 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.362 178.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.612 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 2.3 mm-40 . . . . . 0 N--CA 1.45 -0.472 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.806 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.851 0.358 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.17 -33.14 74.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.042 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -69.74 -39.76 76.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 40.7 t -69.62 -28.35 37.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.674 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.05 -56.41 5.3 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.619 -0.801 . . . . 0.0 111.598 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pp -62.57 -48.68 78.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.724 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.27 -47.47 81.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.26 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 66.6 m -66.15 -34.71 78.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.623 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.5 ' O ' HG23 ' A' ' 23' ' ' VAL . 1.5 t80 -60.95 -55.68 30.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.111 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.6 pp -66.96 -42.78 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 0.0 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -56.46 -51.21 69.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.415 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 20' ' ' PHE . 17.3 m -64.92 -50.16 76.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.479 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.419 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -55.6 -60.57 3.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.074 0.464 . . . . 0.0 110.952 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.39 -32.65 68.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.992 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.4 mt -65.1 -46.69 80.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.913 0.387 . . . . 0.0 110.627 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.2 -55.46 28.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.157 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.42 HG13 ' N ' ' A' ' 29' ' ' HIS . 16.6 pt -62.01 -45.89 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-O 120.8 0.333 . . . . 0.0 111.211 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.42 ' N ' HG13 ' A' ' 28' ' ' ILE . 54.2 t60 -61.97 -36.71 82.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.649 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.28 -42.37 88.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.294 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.512 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -66.69 -50.06 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.319 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.512 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 4.4 pp -62.46 -26.67 68.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 29' ' ' HIS . 0.2 OUTLIER -61.3 -65.61 0.67 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.436 178.168 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.41 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 11.7 m -59.37 -19.08 44.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.194 178.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.8 m -72.66 -63.14 1.22 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.98 0.419 . . . . 0.0 110.786 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.79 -39.06 87.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -36.47 84.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.05 0.452 . . . . 0.0 109.984 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.41 ' CD1' ' O ' ' A' ' 34' ' ' SER . 1.4 m-85 -62.25 -63.26 1.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.261 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.585 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 0.7 OUTLIER -61.15 -18.77 59.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.207 179.657 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 11.9 t-105 -69.98 -72.7 0.18 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.83 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.5 tt -62.43 -17.26 58.88 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.164 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.585 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 10.9 mt-10 . . . . . 0 N--CA 1.448 -0.53 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.537 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.954 0.407 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.466 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.3 -43.53 90.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.527 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.2 mt -67.5 -46.08 73.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.024 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.0 -24.26 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.245 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.52 -56.6 4.98 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.998 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.91 -54.78 29.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.744 0.783 . . . . 0.0 109.856 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.83 -53.81 43.26 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.389 -1.278 . . . . 0.0 112.068 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.425 ' O ' HG22 ' A' ' 23' ' ' VAL . 47.9 m -66.56 -38.25 86.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.605 0.241 . . . . 0.0 111.311 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.485 ' O ' HG22 ' A' ' 23' ' ' VAL . 57.3 t80 -59.86 -54.82 41.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.853 0.359 . . . . 0.0 111.261 -179.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.6 pp -65.72 -48.0 73.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.979 0.419 . . . . 0.0 110.751 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.461 ' O ' ' CB ' ' A' ' 26' ' ' LEU . 4.2 m-85 -53.53 -55.83 22.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.478 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 20' ' ' PHE . 17.9 m -60.28 -48.04 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.821 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.417 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.3 OUTLIER -52.03 -67.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.949 0.404 . . . . 0.0 110.845 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.07 -24.75 64.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.995 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.461 ' CB ' ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -65.22 -54.21 32.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.45 179.702 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.43 ' CD2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -62.88 -44.61 95.64 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.948 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.448 ' O ' HG13 ' A' ' 31' ' ' ILE . 38.2 mm -62.9 -57.06 13.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.198 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.762 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 m-70 -61.41 -39.59 91.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.322 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.405 ' O ' ' CB ' ' A' ' 34' ' ' SER . 68.8 t80 -60.78 -51.41 69.47 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 28' ' ' ILE . 2.2 pp -67.8 -50.61 58.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.461 ' CD1' ' N ' ' A' ' 33' ' ' LEU . 4.5 pp -60.32 -51.32 70.04 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.672 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.762 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -62.73 -51.23 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.758 0.314 . . . . 0.0 110.355 179.349 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' A' ' 30' ' ' PHE . 68.6 m -61.91 -70.8 0.17 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.3 m -43.03 -42.2 3.76 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.801 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -63.03 -47.94 80.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.993 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -35.48 81.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.65 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 4.7 m-85 -62.0 -66.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.636 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.496 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 44.1 m-20 -58.96 -20.19 50.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.127 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 27.6 t90 -67.99 -70.96 0.23 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.6 -16.11 59.98 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.007 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 1.6 tp10 . . . . . 0 N--CA 1.449 -0.476 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.5 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.899 0.38 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.6 85.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.746 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.29 -39.69 78.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.919 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.1 t -70.96 -27.4 29.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.713 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.42 -54.18 6.29 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.768 -0.73 . . . . 0.0 111.845 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -61.95 -49.98 73.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.933 0.397 . . . . 0.0 110.69 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.32 -50.34 73.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.018 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.419 ' O ' ' CG1' ' A' ' 23' ' ' VAL . 87.2 m -67.48 -30.83 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.602 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.461 ' O ' HG23 ' A' ' 23' ' ' VAL . 37.7 t80 -60.48 -61.03 2.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.377 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.38 -41.75 93.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.939 0.4 . . . . 0.0 110.773 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -55.62 -53.46 56.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.493 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 20' ' ' PHE . 13.4 m -65.77 -49.6 76.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.677 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.441 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -55.05 -58.78 6.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.641 -179.8 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.89 -47.89 83.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.345 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.403 ' HG ' HD23 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -62.83 -42.62 99.8 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.428 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.405 ' CD2' ' O ' ' A' ' 23' ' ' VAL . 1.9 mm? -60.37 -55.6 31.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.808 0.337 . . . . 0.0 111.086 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.443 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 42.6 mt -61.81 -54.93 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.982 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.492 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 57.3 m80 -54.95 -38.82 68.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.666 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.473 ' O ' HD21 ' A' ' 33' ' ' LEU . 20.2 t80 -64.67 -33.09 75.12 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.436 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.7 tt -71.65 -46.25 63.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.796 0.332 . . . . 0.0 110.626 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 28' ' ' ILE . 4.0 mt -65.34 -54.51 27.94 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-O 121.157 0.503 . . . . 0.0 110.072 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.492 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -56.85 -40.15 75.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.12 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.453 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 19.9 t -62.24 -49.79 74.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.717 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.1 m -60.19 -46.12 90.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.091 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 5.4 tt0 -63.2 -43.66 97.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.87 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.03 -40.26 94.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.664 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.472 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.9 m-85 -61.0 -65.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.597 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.492 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-20 -59.37 -19.42 46.69 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.979 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.415 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 1.3 m0 -67.55 -71.41 0.21 Allowed 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -63.61 -15.8 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.092 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.492 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 18.5 tt0 . . . . . 0 N--CA 1.449 -0.497 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.639 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.801 0.334 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -62.78 -36.57 83.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 mt -66.63 -40.79 88.92 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.33 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.8 t -68.08 -23.75 29.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.165 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CD1' ' A' ' 20' ' ' PHE . . . -74.28 -48.37 14.84 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.372 179.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -61.93 -57.03 13.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.353 0.596 . . . . 0.0 110.09 179.28 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.24 -50.62 64.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.37 -179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.403 ' O ' ' CG1' ' A' ' 23' ' ' VAL . 81.2 m -66.82 -32.02 73.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.01 0.433 . . . . 0.0 110.683 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 16' ' ' GLY . 1.4 m-85 -60.06 -69.69 0.2 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.384 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.446 ' CD2' ' C ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -63.05 -32.41 73.78 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.822 -179.553 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.426 ' N ' ' CD1' ' A' ' 21' ' ' LEU . 37.9 t80 -59.26 -58.09 10.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.927 0.394 . . . . 0.0 110.614 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.475 ' CG2' ' N ' ' A' ' 24' ' ' LEU . 5.0 m -65.67 -52.15 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.388 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.475 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.7 OUTLIER -51.91 -56.85 11.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.161 0.505 . . . . 0.0 111.159 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.71 71.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.897 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER -64.76 -51.85 60.1 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.354 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.421 ' N ' ' HG ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -66.28 -49.01 68.57 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 111.068 179.853 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.484 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.6 mp -60.66 -58.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.712 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.605 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 20.7 t-80 -54.46 -34.09 60.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.851 0.358 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.42 ' O ' HD22 ' A' ' 33' ' ' LEU . 82.2 t80 -63.9 -38.47 91.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.813 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.454 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.4 tp -72.23 -46.59 57.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.67 0.272 . . . . 0.0 111.253 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 28' ' ' ILE . 2.8 mt -64.5 -54.08 38.01 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.95 0.405 . . . . 0.0 110.421 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.605 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -57.42 -40.03 77.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.165 179.701 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.43 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 26.4 t -61.61 -56.7 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.148 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.7 m -60.58 -48.88 79.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 7.2 tt0 -62.46 -36.68 83.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.049 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -64.36 -45.26 88.54 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.956 0.408 . . . . 0.0 110.472 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.468 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.1 t80 -61.08 -60.99 2.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.179 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.502 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 85.5 m-20 -60.79 -18.93 58.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.025 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.413 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 0.8 OUTLIER -68.53 -70.15 0.28 Allowed 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.377 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 59.5 tp -63.5 -16.01 59.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.502 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 28.1 tt0 . . . . . 0 N--CA 1.45 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.647 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.0 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.768 0.318 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 44.8 29.47 0.44 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.627 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.2 mtt180 45.27 29.76 0.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.561 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 25.2 mm 50.61 47.67 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.208 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.447 ' N ' ' CD1' ' A' ' 5' ' ' TRP . 7.3 m95 33.89 37.58 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.773 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.01 36.83 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.931 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 48.1 mt -85.11 -68.47 0.72 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.626 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -140.41 81.36 1.8 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.761 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.445 ' CB ' ' HD3' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -167.02 -56.27 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.336 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.445 ' HD3' ' CB ' ' A' ' 9' ' ' ASP . 51.4 Cg_exo -55.55 -58.89 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.229 1.953 . . . . 0.0 112.354 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -57.06 -49.58 75.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.028 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -59.39 -36.13 75.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.855 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.23 -46.52 83.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.017 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.6 mt -66.86 -35.69 80.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.271 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.3 t -70.54 -27.36 30.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.535 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.68 -49.13 11.29 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.098 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.61 -57.77 9.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.566 0.698 . . . . 0.0 109.862 179.392 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.51 -48.67 68.79 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.745 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.413 ' O ' HG23 ' A' ' 23' ' ' VAL . 93.2 m -68.29 -37.55 80.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.513 ' O ' HG23 ' A' ' 23' ' ' VAL . 38.7 t80 -60.11 -52.68 64.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.355 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.4 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 3.5 pp -66.51 -49.15 67.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.909 0.385 . . . . 0.0 110.804 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.4 ' N ' ' CD1' ' A' ' 21' ' ' LEU . 7.7 t80 -54.18 -49.23 69.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.767 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 20' ' ' PHE . 22.1 m -65.76 -48.56 81.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.618 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.407 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.3 OUTLIER -52.35 -65.04 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.98 0.419 . . . . 0.0 111.373 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.64 -31.74 66.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.182 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.3 mt -63.99 -49.44 72.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.644 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mt -62.83 -37.89 88.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.914 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 14.6 mt -63.12 -62.88 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.124 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.559 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 3.2 m170 -59.94 -38.6 82.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.032 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.442 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 25.6 t80 -64.66 -45.25 87.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.732 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.472 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.8 OUTLIER -68.71 -47.61 75.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.407 -179.591 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.472 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 4.3 pp -65.97 -47.71 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.936 0.398 . . . . 0.0 110.305 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.559 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.6 OUTLIER -61.9 -45.47 93.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.401 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.6 t -62.09 -55.27 30.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.414 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.1 m -62.43 -39.58 93.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -64.61 -57.69 8.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.24 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -37.41 87.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.143 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.48 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 85.9 t80 -61.49 -66.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.552 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.0 t-20 -57.84 -20.44 36.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.233 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -68.68 -70.68 0.25 Allowed 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -63.44 -17.34 62.59 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.552 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 46.0 tp10 -63.45 -53.44 52.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.539 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.03 112.34 1.67 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.384 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.425 ' O ' ' CB ' ' A' ' 45' ' ' SER . . . -172.11 74.25 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.846 0.355 . . . . 0.0 110.753 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' 44' ' ' ALA . 0.8 OUTLIER 83.42 26.92 0.1 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.863 -179.732 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.5 p -149.28 -57.78 0.2 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.948 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.53 -60.32 0.62 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.89 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.36 76.92 3.73 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.561 2.174 . . . . 0.0 112.439 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.429 ' O ' ' N ' ' A' ' 51' ' ' THR . 3.0 m -94.5 126.24 46.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.178 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 41.78 -91.04 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.681 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.429 ' N ' ' O ' ' A' ' 49' ' ' VAL . 0.8 OUTLIER -159.78 125.42 4.17 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.818 0.342 . . . . 0.0 110.849 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.898 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.746 0.308 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 2.6 m-90 38.89 34.07 0.09 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.673 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 14.1 mtp85 52.37 57.5 6.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.922 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.416 ' O ' ' N ' ' A' ' 6' ' ' GLN . 4.1 mp 46.89 28.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.201 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 35.12 32.86 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.811 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.416 ' N ' ' O ' ' A' ' 4' ' ' ILE . 4.1 mt-30 -171.59 20.19 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.0 mt -83.16 -59.13 2.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.035 0.445 . . . . 0.0 110.502 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -138.06 83.12 1.95 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.747 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.429 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -164.52 -64.49 0.01 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.836 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 9' ' ' ASP . 10.7 Cg_endo -53.87 -53.47 6.37 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.506 2.137 . . . . 0.0 112.187 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -55.38 -56.02 24.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.821 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -59.21 -30.73 68.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.738 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.458 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -63.6 -49.15 74.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.941 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.06 -36.15 82.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.285 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.1 t -67.83 -27.61 38.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.081 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.12 -42.53 35.94 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.829 -0.7 . . . . 0.0 111.55 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.7 -61.49 2.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.24 0.543 . . . . 0.0 110.368 179.25 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.56 74.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.897 -179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.409 ' O ' HG22 ' A' ' 23' ' ' VAL . 96.4 m -68.09 -42.68 79.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.718 0.294 . . . . 0.0 111.212 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.485 ' O ' HG22 ' A' ' 23' ' ' VAL . 28.3 t80 -60.75 -49.37 77.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.48 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.403 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 3.2 pp -65.71 -50.66 64.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.858 0.361 . . . . 0.0 110.848 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.403 ' N ' ' CD1' ' A' ' 21' ' ' LEU . 2.0 t80 -55.48 -49.98 71.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.66 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 20' ' ' PHE . 22.3 m -63.4 -50.61 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.41 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.0 OUTLIER -59.46 -34.74 72.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.983 0.421 . . . . 0.0 110.18 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.06 -53.57 53.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.954 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 23' ' ' VAL . 1.3 pp -62.94 -33.62 75.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.82 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.421 HD21 ' HG ' ' A' ' 26' ' ' LEU . 2.0 mm? -62.66 -48.41 79.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.831 0.348 . . . . 0.0 110.701 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 9.2 mt -63.45 -54.32 34.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.159 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.548 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 t60 -58.98 -40.05 83.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.994 0.426 . . . . 0.0 110.81 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.479 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 24.0 t80 -65.09 -44.48 88.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.5 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.475 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 2.5 tp -68.59 -47.88 74.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.081 -0.247 . . . . 0.0 111.294 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.475 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 4.3 pp -65.49 -48.72 71.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.851 0.358 . . . . 0.0 110.173 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.548 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.5 OUTLIER -61.31 -41.71 97.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.206 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -62.79 -59.53 4.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.15 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.0 m -59.51 -48.18 82.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.505 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 2.6 pp20? -62.13 -43.52 98.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -66.58 -36.84 83.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.047 0.451 . . . . 0.0 110.473 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.503 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 10.7 t80 -61.81 -65.74 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.711 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.483 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 58.4 m-80 -57.63 -22.05 43.21 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.986 0.422 . . . . 0.0 111.13 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -67.44 -70.57 0.25 Allowed 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 pp -64.41 -14.84 58.87 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.031 177.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.503 ' HB2' ' O ' ' A' ' 38' ' ' PHE . 2.2 tt0 -63.4 -67.22 0.44 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.508 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.469 ' O ' ' N ' ' A' ' 45' ' ' SER . . . -167.82 -66.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.541 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 39.89 -86.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 43' ' ' GLY . 16.1 p -70.69 -28.58 64.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.653 0.263 . . . . 0.0 111.413 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.4 p -87.05 -13.84 43.22 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.261 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -77.25 142.67 68.2 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.665 0.269 . . . . 0.0 110.764 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.63 128.07 26.78 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.546 2.164 . . . . 0.0 112.388 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.6 t -142.64 -48.4 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.963 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -164.24 84.34 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.884 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 26.2 p 52.46 86.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.101 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.1 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.291 -0.861 . . . . 0.0 110.887 -179.999 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 ptt? . . . . . 0 N--CA 1.488 1.433 0 CA-C-O 120.626 0.251 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.414 ' CD1' ' HG2' ' A' ' 10' ' ' PRO . 1.5 t-105 40.08 65.75 0.7 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.7 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 52.7 25.49 3.81 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.113 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.413 ' O ' ' C ' ' A' ' 5' ' ' TRP . 11.3 mm 44.17 30.3 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.209 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.413 ' C ' ' O ' ' A' ' 4' ' ' ILE . 19.8 m95 32.55 51.23 0.23 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.521 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -171.75 -30.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.872 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 24.2 mt -81.41 -50.57 9.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.735 0.302 . . . . 0.0 110.963 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -103.49 -39.36 6.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.892 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 78.69 69.27 0.18 Allowed Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.839 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.433 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 32.2 Cg_exo -58.45 -38.01 92.1 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.693 2.262 . . . . 0.0 112.526 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.42 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -54.83 -66.16 0.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.567 -179.589 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.418 ' HA ' HG11 ' A' ' 15' ' ' VAL . 4.1 pp0? -58.36 -45.05 88.95 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.933 0.396 . . . . 0.0 111.465 -179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.87 -36.14 78.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.769 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HB3' ' O ' ' A' ' 10' ' ' PRO . 0.6 OUTLIER -72.23 -41.34 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.619 0.247 . . . . 0.0 111.056 -179.654 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.422 ' N ' ' HG ' ' A' ' 14' ' ' LEU . 7.2 p -70.25 -26.57 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.592 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.76 -54.82 5.7 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.881 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.403 ' CD1' ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -63.12 -49.19 75.39 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.979 0.419 . . . . 0.0 110.91 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.403 ' N ' ' CD1' ' A' ' 17' ' ' LEU . . . -59.59 -47.34 85.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.746 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.406 ' O ' HG22 ' A' ' 23' ' ' VAL . 81.7 m -66.6 -50.6 62.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.39 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.464 ' O ' HG22 ' A' ' 23' ' ' VAL . 69.5 t80 -59.92 -44.51 94.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.738 0.304 . . . . 0.0 111.283 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.17 -54.81 17.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.967 0.413 . . . . 0.0 110.704 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.82 -48.21 70.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.799 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 20' ' ' PHE . 22.7 m -64.12 -49.31 81.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 111.661 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.415 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -58.27 -57.92 10.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.012 0.434 . . . . 0.0 111.265 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.5 73.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.815 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.81 -37.35 84.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 0.0 110.891 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.417 ' O ' ' CD1' ' A' ' 30' ' ' PHE . 1.9 mp -60.05 -56.52 20.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.604 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.0 mm -63.4 -28.7 45.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.809 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.412 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.9 t-80 -62.79 -65.09 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.245 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 27' ' ' LEU . 2.3 p90 -62.43 -31.61 72.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.561 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.511 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.5 tp -69.59 -51.69 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.911 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.511 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 2.0 pp -64.29 -41.39 96.9 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.9 mt -60.32 -59.06 6.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.589 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.403 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 2.4 t -59.98 -28.11 67.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.189 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 m -66.09 -52.69 46.41 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.977 0.418 . . . . 0.0 110.536 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -62.41 -45.14 94.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.624 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.9 mmt-85 -64.74 -36.23 83.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.504 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.525 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.9 m-85 -61.21 -66.35 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.386 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.554 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 11.9 m-80 -59.81 -18.77 46.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.845 0.355 . . . . 0.0 111.16 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 72.8 t-105 -68.11 -74.91 0.11 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.793 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' CD1' ' O ' ' A' ' 38' ' ' PHE . 0.0 OUTLIER -63.19 -15.21 56.2 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.183 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.554 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 4.7 tt0 -63.07 -63.33 1.23 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.291 179.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 89.66 46.02 4.41 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.505 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.5 -47.29 73.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.819 0.342 . . . . 0.0 111.088 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -31.77 66.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.957 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.8 p -87.78 -74.04 0.46 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.958 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 4.5 tttt 72.7 146.6 0.12 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.787 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.403 ' O ' ' N ' ' A' ' 50' ' ' GLN . 57.0 Cg_endo -70.86 130.58 18.2 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.535 2.157 . . . . 0.0 112.313 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.7 t 62.74 -77.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.181 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' A' ' 48' ' ' PRO . 4.3 tt0 76.13 153.83 0.15 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.866 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.7 m -80.22 -65.4 1.01 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.886 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.579 ' O ' ' N ' ' A' ' 3' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.531 0.205 . . . . 0.0 111.097 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 47.38 -77.79 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.301 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.579 ' N ' ' O ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -69.16 -8.72 48.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.427 -179.282 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.412 ' CD1' ' HA ' ' A' ' 1' ' ' MET . 35.3 pt -72.91 -21.95 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.506 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 1.0 OUTLIER -68.28 -12.92 61.81 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.357 178.473 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.506 ' CB ' ' O ' ' A' ' 5' ' ' TRP . 1.9 tt0 90.7 87.4 0.01 OUTLIER 'General case' 0 C--N 1.342 0.274 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.785 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.78 -42.42 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.024 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -133.62 32.35 3.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.893 0.377 . . . . 0.0 110.913 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.3 p30 -72.39 162.25 74.84 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.807 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -48.37 -46.87 21.81 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.665 2.244 . . . . 0.0 112.718 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.48 -50.95 66.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.086 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -59.32 -39.59 83.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.759 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.478 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.11 -40.25 94.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.33 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.3 mt -66.02 -43.6 87.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.608 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m -69.28 -22.01 25.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.624 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.41 -50.13 10.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.772 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -63.91 -55.73 20.49 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.643 0.735 . . . . 0.0 109.558 178.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.13 -38.28 65.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.528 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.416 ' O ' HG22 ' A' ' 23' ' ' VAL . 4.5 m -67.61 -42.87 81.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.828 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.519 ' O ' HG22 ' A' ' 23' ' ' VAL . 18.4 t80 -60.76 -51.84 67.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.089 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.6 pp -66.31 -47.73 72.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.611 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -55.71 -48.61 74.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.766 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 20' ' ' PHE . 25.3 m -65.24 -49.03 81.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.814 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.16 -44.81 92.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.913 0.387 . . . . 0.0 110.569 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.18 -56.82 16.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.238 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.84 -28.67 70.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.752 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.48 -60.43 3.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.736 179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 5.1 mt -62.77 -44.98 99.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.942 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.611 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 39.8 m170 -60.23 -42.56 95.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.444 ' O ' HD22 ' A' ' 33' ' ' LEU . 19.5 t80 -64.63 -38.38 90.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.591 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.469 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -70.38 -47.83 63.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.03 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.469 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 3.3 pp -65.23 -51.51 60.49 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.611 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -59.4 -40.08 85.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.272 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.453 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 27.4 t -61.51 -49.99 74.52 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.58 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.4 m -59.39 -44.17 92.84 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.63 -49.6 74.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -64.9 -32.31 73.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.486 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.495 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.7 m-85 -62.19 -63.97 1.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.442 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.489 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-80 -58.67 -21.68 54.91 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 110.983 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.423 ' CD1' ' HB2' ' A' ' 45' ' ' SER . 0.0 OUTLIER -67.55 -70.49 0.25 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.288 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.12 -15.41 56.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' A' ' 38' ' ' PHE . 13.3 tp10 -63.88 -50.97 66.69 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.709 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -167.18 -31.94 0.02 OUTLIER Glycine 0 C--N 1.333 0.362 0 C-N-CA 120.333 -0.937 . . . . 0.0 113.288 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.21 -45.25 89.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.859 0.329 . . . . 0.0 111.323 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.423 ' HB2' ' CD1' ' A' ' 40' ' ' TRP . 4.5 t -72.19 -25.75 61.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.177 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.9 p -86.84 -24.96 24.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.071 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.4 mtmm -161.44 72.14 2.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.756 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.31 -44.44 0.55 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.523 2.149 . . . . 0.0 112.259 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.6 t -145.32 133.32 16.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 45.13 38.66 3.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.407 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 11.0 p 53.48 55.52 8.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.044 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.82 -179.968 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 ptp . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.73 0.3 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.7 m95 38.41 57.05 1.75 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.62 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 20.4 mtp85 56.63 39.2 29.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.023 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.5 mm 50.65 38.61 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.019 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 45.2 p90 35.23 35.57 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.789 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.444 ' O ' ' N ' ' A' ' 8' ' ' PHE . 14.2 tt0 -173.25 -84.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.862 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.1 mt 55.99 -83.74 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.743 0.306 . . . . 0.0 111.124 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.444 ' N ' ' O ' ' A' ' 6' ' ' GLN . 8.6 m-85 -136.21 80.78 1.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.794 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.522 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -71.78 -43.69 11.39 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.259 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 9' ' ' ASP . 51.6 Cg_exo -54.46 -36.72 88.92 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.3 2.0 . . . . 0.0 112.385 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.91 -69.38 0.16 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.411 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.58 -46.68 77.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.979 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.11 70.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.08 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.1 mt -69.94 -44.8 68.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.767 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 10.6 p -68.91 -27.08 34.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -73.48 -55.27 6.18 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.746 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.402 ' CD1' ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -61.69 -47.88 83.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.062 0.458 . . . . 0.0 110.51 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.402 ' N ' ' CD1' ' A' ' 17' ' ' LEU . . . -58.42 -37.51 75.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.369 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.0 m -67.08 -55.3 14.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.028 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.452 ' O ' HG23 ' A' ' 23' ' ' VAL . 4.0 t80 -59.63 -44.33 93.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.334 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.467 ' CD2' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.03 -57.77 6.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.467 ' N ' ' CD2' ' A' ' 21' ' ' LEU . 72.5 t80 -50.63 -49.12 57.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.77 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 20' ' ' PHE . 19.4 m -64.16 -50.28 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.737 0.303 . . . . 0.0 111.525 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.429 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 10.5 tp -52.83 -65.28 0.59 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 111.072 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.63 -22.93 25.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.576 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -66.34 -53.44 36.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 179.152 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.11 -46.9 85.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 110.551 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.443 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 39.3 mm -63.6 -61.33 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.968 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.435 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 25.1 t-80 -55.11 -43.18 73.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.218 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.453 ' O ' HD22 ' A' ' 33' ' ' LEU . 57.0 t80 -61.52 -31.56 71.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.057 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.453 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.4 tt -72.87 -47.23 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.827 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.453 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 4.1 mt -64.75 -54.24 34.57 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.15 0.5 . . . . 0.0 110.017 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.453 HD22 ' O ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -56.35 -39.02 72.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.957 179.449 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.422 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 3.6 m -60.72 -51.04 71.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.0 m -62.82 -38.1 89.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.747 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -63.83 -45.7 88.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.706 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -36.82 85.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.452 . . . . 0.0 110.39 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.425 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.6 m-85 -61.4 -64.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.591 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 11.4 m-20 -60.77 -18.1 52.99 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.234 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -69.75 -73.68 0.15 Allowed 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.757 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.76 -16.71 58.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.195 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.591 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 6.7 mm-40 -64.78 -69.03 0.31 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.675 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -168.1 33.83 0.2 Allowed Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.518 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.415 ' O ' ' CB ' ' A' ' 45' ' ' SER . . . -66.43 113.65 4.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.696 0.284 . . . . 0.0 111.155 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.415 ' CB ' ' O ' ' A' ' 44' ' ' ALA . 0.3 OUTLIER 80.51 26.48 0.29 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.996 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.4 p -149.06 -46.83 0.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.852 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.34 130.12 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.465 ' O ' HG11 ' A' ' 49' ' ' VAL . 51.1 Cg_exo -53.09 109.14 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.433 2.089 . . . . 0.0 112.313 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.465 HG11 ' O ' ' A' ' 48' ' ' PRO . 0.3 OUTLIER 55.77 -175.14 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.337 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.429 ' N ' ' CG1' ' A' ' 49' ' ' VAL . 5.3 mt-30 78.06 74.2 0.06 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.845 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.0 t -79.96 139.5 37.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.944 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 71.6 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.907 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 mmt . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.753 0.311 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 9.8 m-90 39.14 67.06 0.47 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.714 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.464 ' CB ' ' HA ' ' A' ' 7' ' ' LEU . 1.9 mmt85 54.41 26.89 7.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.211 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.472 ' O ' ' CB ' ' A' ' 5' ' ' TRP . 19.8 mm 59.05 18.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.081 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.472 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 3.0 t-105 86.18 -23.98 0.14 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.728 0.299 . . . . 0.0 111.048 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.423 ' HB3' ' CB ' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -67.4 -31.55 71.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.932 0.396 . . . . 0.0 110.252 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.464 ' HA ' ' CB ' ' A' ' 3' ' ' ARG . 0.3 OUTLIER 59.12 81.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.759 179.323 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.437 ' CZ ' ' NH1' ' A' ' 3' ' ' ARG . 87.3 m-85 54.43 21.35 3.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.997 178.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.433 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -73.15 -51.65 5.87 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.665 0.269 . . . . 0.0 110.91 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 9' ' ' ASP . 53.1 Cg_exo -55.17 -29.31 65.67 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.534 2.156 . . . . 0.0 112.295 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 51.1 ttt-85 -63.78 -72.58 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.974 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -58.94 -35.97 73.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.98 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.485 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.19 -46.08 85.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.113 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.13 -34.23 77.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.404 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.3 t -68.21 -28.72 41.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.149 179.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.34 -43.41 31.48 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.617 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.3 -61.04 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.236 0.541 . . . . 0.0 110.424 179.416 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.86 -47.83 76.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.075 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 89.7 m -66.0 -51.24 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.685 0.279 . . . . 0.0 111.29 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.409 ' O ' HG22 ' A' ' 23' ' ' VAL . 12.9 t80 -59.61 -35.53 74.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.456 ' CD2' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.78 -61.26 1.96 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.678 179.655 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.456 ' N ' ' CD2' ' A' ' 21' ' ' LEU . 25.7 t80 -54.02 -44.22 70.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.986 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.409 HG22 ' O ' ' A' ' 20' ' ' PHE . 29.2 m -65.2 -49.21 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.49 -45.25 94.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.893 0.378 . . . . 0.0 110.719 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.99 -39.75 86.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.794 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.415 HD11 ' CE2' ' A' ' 22' ' ' PHE . 23.1 mt -64.38 -41.57 96.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.736 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.09 -57.46 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.077 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.48 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 2.2 pp -60.75 -50.98 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.201 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.483 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 32.4 t-80 -56.78 -38.1 72.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.909 0.385 . . . . 0.0 110.456 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.488 ' O ' HD22 ' A' ' 33' ' ' LEU . 43.5 t80 -64.7 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.892 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.435 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -71.24 -45.59 69.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.82 0.343 . . . . 0.0 110.651 179.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 28' ' ' ILE . 3.7 mt -65.67 -53.99 33.68 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.08 0.467 . . . . 0.0 110.091 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -57.81 -40.99 81.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.228 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.459 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 65.2 p -62.66 -49.79 73.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.722 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.9 m -61.77 -41.07 97.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.112 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.71 -53.22 54.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.92 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -63.85 -35.03 79.29 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.597 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.448 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 51.2 t80 -60.02 -66.3 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.429 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.612 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 13.4 m-80 -59.67 -17.55 34.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.034 0.445 . . . . 0.0 111.033 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -68.27 -75.98 0.1 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.819 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.92 -16.18 58.15 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.362 178.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.612 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 2.3 mm-40 -64.84 -55.95 16.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.806 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -167.33 -20.18 0.02 OUTLIER Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.532 -0.842 . . . . 0.0 113.42 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.63 -23.82 67.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.992 0.396 . . . . 0.0 111.313 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.17 -36.68 69.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.886 0.374 . . . . 0.0 110.709 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 11.7 p -88.29 -31.66 18.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.848 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 20.2 tttm 74.24 87.82 0.09 OUTLIER Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.853 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.404 ' O ' HG13 ' A' ' 49' ' ' VAL . 57.3 Cg_endo -70.92 -167.98 0.3 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.577 2.185 . . . . 0.0 112.296 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.404 HG13 ' O ' ' A' ' 48' ' ' PRO . 0.4 OUTLIER 57.82 172.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -164.17 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.908 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.9 m -80.18 86.23 5.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.865 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.9 mtp . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.697 0.284 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 3.0 m0 40.37 33.26 0.16 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.718 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 28.2 mtt85 52.69 46.43 26.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.988 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.501 ' O ' ' CB ' ' A' ' 5' ' ' TRP . 14.7 mm 45.65 28.53 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.283 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.501 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 3.1 t90 90.41 -42.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.816 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -176.21 -35.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.236 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 69.41 -67.62 0.22 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.826 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.502 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 3.6 m-85 -103.71 -60.0 1.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.895 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.645 ' HB3' ' HD3' ' A' ' 10' ' ' PRO . 5.9 t0 100.67 -60.6 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.68 0 C-N-CA 123.828 0.851 . . . . 0.0 111.981 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.645 ' HD3' ' HB3' ' A' ' 9' ' ' ASP . 52.2 Cg_exo -54.89 -34.41 85.68 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 121.747 1.631 . . . . 0.0 112.137 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -69.63 -47.87 61.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.94 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -52.98 63.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.996 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.17 -33.14 74.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.042 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -69.74 -39.76 76.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 40.7 t -69.62 -28.35 37.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.674 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.05 -56.41 5.3 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.619 -0.801 . . . . 0.0 111.598 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 pp -62.57 -48.68 78.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.724 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.27 -47.47 81.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.26 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 66.6 m -66.15 -34.71 78.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.623 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.5 ' O ' HG23 ' A' ' 23' ' ' VAL . 1.5 t80 -60.95 -55.68 30.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.111 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.6 pp -66.96 -42.78 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 0.0 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -56.46 -51.21 69.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.415 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 20' ' ' PHE . 17.3 m -64.92 -50.16 76.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.479 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.419 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -55.6 -60.57 3.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.074 0.464 . . . . 0.0 110.952 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.39 -32.65 68.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.992 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.4 mt -65.1 -46.69 80.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.913 0.387 . . . . 0.0 110.627 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.2 -55.46 28.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.157 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.42 HG13 ' N ' ' A' ' 29' ' ' HIS . 16.6 pt -62.01 -45.89 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-O 120.8 0.333 . . . . 0.0 111.211 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.42 ' N ' HG13 ' A' ' 28' ' ' ILE . 54.2 t60 -61.97 -36.71 82.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.649 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.28 -42.37 88.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.294 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.512 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -66.69 -50.06 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.319 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.512 ' N ' ' CG2' ' A' ' 31' ' ' ILE . 4.4 pp -62.46 -26.67 68.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 29' ' ' HIS . 0.2 OUTLIER -61.3 -65.61 0.67 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.436 178.168 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.41 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 11.7 m -59.37 -19.08 44.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.194 178.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.8 m -72.66 -63.14 1.22 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.98 0.419 . . . . 0.0 110.786 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.79 -39.06 87.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -36.47 84.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.05 0.452 . . . . 0.0 109.984 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.41 ' CD1' ' O ' ' A' ' 34' ' ' SER . 1.4 m-85 -62.25 -63.26 1.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.261 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.585 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 0.7 OUTLIER -61.15 -18.77 59.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.207 179.657 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 11.9 t-105 -69.98 -72.7 0.18 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.83 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.5 tt -62.43 -17.26 58.88 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.164 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.585 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 10.9 mt-10 -64.21 -66.26 0.57 Allowed 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.537 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.443 ' O ' ' HD2' ' A' ' 48' ' ' PRO . . . -167.72 88.53 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.659 -0.782 . . . . 0.0 112.388 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.414 ' O ' ' CB ' ' A' ' 45' ' ' SER . . . -66.61 79.02 0.11 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.805 0.336 . . . . 0.0 110.902 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.414 ' CB ' ' O ' ' A' ' 44' ' ' ALA . 4.3 t 81.24 35.2 0.1 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.679 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.3 p -146.53 8.65 1.03 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.851 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HB3' ' CD ' ' A' ' 48' ' ' PRO . 10.5 ttpt -161.71 -65.96 0.02 OUTLIER Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 121.088 -0.245 . . . . 0.0 111.168 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.471 ' CD ' ' HB3' ' A' ' 47' ' ' LYS . 12.5 Cg_endo -55.61 -70.96 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.513 2.142 . . . . 0.0 112.241 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.1 t -95.5 161.61 2.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.887 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 46.18 -167.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.162 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.6 33.67 15.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.001 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.913 -179.951 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.721 0.296 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 60.5 m95 39.12 33.99 0.1 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.626 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.5 mtt85 51.64 48.23 23.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.086 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.51 ' O ' ' CB ' ' A' ' 5' ' ' TRP . 23.3 mm 46.63 29.61 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.241 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.51 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 0.9 OUTLIER 92.19 -43.82 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.924 -179.698 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 8' ' ' PHE . 5.7 pt20 -174.35 30.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.348 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.8 mt 59.46 -82.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.973 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.426 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 18.2 m-85 -139.81 34.81 1.98 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.629 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.426 ' CB ' ' O ' ' A' ' 8' ' ' PHE . 0.9 OUTLIER 81.76 129.16 0.03 OUTLIER Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.677 -179.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -59.66 -35.06 96.07 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.331 2.021 . . . . 0.0 112.365 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.58 -61.49 1.78 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.281 -179.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -58.75 -42.03 87.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.954 0.407 . . . . 0.0 111.272 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.466 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.3 -43.53 90.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.527 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.2 mt -67.5 -46.08 73.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.024 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.0 -24.26 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.245 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.52 -56.6 4.98 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.998 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.91 -54.78 29.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.744 0.783 . . . . 0.0 109.856 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.83 -53.81 43.26 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.389 -1.278 . . . . 0.0 112.068 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.425 ' O ' HG22 ' A' ' 23' ' ' VAL . 47.9 m -66.56 -38.25 86.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.605 0.241 . . . . 0.0 111.311 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.485 ' O ' HG22 ' A' ' 23' ' ' VAL . 57.3 t80 -59.86 -54.82 41.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.853 0.359 . . . . 0.0 111.261 -179.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.6 pp -65.72 -48.0 73.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.979 0.419 . . . . 0.0 110.751 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.461 ' O ' ' CB ' ' A' ' 26' ' ' LEU . 4.2 m-85 -53.53 -55.83 22.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.478 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 20' ' ' PHE . 17.9 m -60.28 -48.04 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.821 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.417 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.3 OUTLIER -52.03 -67.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.949 0.404 . . . . 0.0 110.845 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.07 -24.75 64.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.995 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.461 ' CB ' ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -65.22 -54.21 32.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.45 179.702 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.43 ' CD2' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -62.88 -44.61 95.64 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.948 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.448 ' O ' HG13 ' A' ' 31' ' ' ILE . 38.2 mm -62.9 -57.06 13.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.198 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.762 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 m-70 -61.41 -39.59 91.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.322 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.405 ' O ' ' CB ' ' A' ' 34' ' ' SER . 68.8 t80 -60.78 -51.41 69.47 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 28' ' ' ILE . 2.2 pp -67.8 -50.61 58.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.461 ' CD1' ' N ' ' A' ' 33' ' ' LEU . 4.5 pp -60.32 -51.32 70.04 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.672 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.762 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -62.73 -51.23 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.758 0.314 . . . . 0.0 110.355 179.349 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' A' ' 30' ' ' PHE . 68.6 m -61.91 -70.8 0.17 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.3 m -43.03 -42.2 3.76 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.801 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -63.03 -47.94 80.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.993 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -35.48 81.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.65 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 4.7 m-85 -62.0 -66.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.636 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.496 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 44.1 m-20 -58.96 -20.19 50.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.127 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 27.6 t90 -67.99 -70.96 0.23 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.6 -16.11 59.98 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.007 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 1.6 tp10 -62.97 -70.94 0.18 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.5 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.453 ' O ' ' CB ' ' A' ' 44' ' ' ALA . . . -73.01 -97.38 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.575 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 43' ' ' GLY . . . 86.37 -73.42 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.105 0 C-N-CA 122.584 0.353 . . . . 0.0 111.097 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 97.8 p -72.71 -41.42 65.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.735 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.439 ' O ' ' CG ' ' A' ' 47' ' ' LYS . 6.7 p -88.51 -41.04 12.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.827 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.439 ' CG ' ' O ' ' A' ' 46' ' ' THR . 0.1 OUTLIER 52.1 168.19 0.04 OUTLIER Pre-proline 0 CA--C 1.532 0.25 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.488 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.1 -176.89 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.554 2.17 . . . . 0.0 112.322 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.405 ' CG1' ' O ' ' A' ' 49' ' ' VAL . 38.2 t 57.0 27.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.104 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 43.89 78.44 0.05 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.532 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.78 30.15 13.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.149 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.274 -0.869 . . . . 0.0 110.968 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 mmt . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.698 0.285 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 46.0 m95 38.62 71.48 0.16 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.687 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.452 ' O ' ' HG ' ' A' ' 7' ' ' LEU . 3.3 mmt-85 57.95 21.86 8.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.16 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.464 ' O ' ' CB ' ' A' ' 5' ' ' TRP . 3.6 mp 61.1 11.22 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.782 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.464 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 0.6 OUTLIER 87.03 -12.0 0.55 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 179.563 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -174.02 -26.64 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 3' ' ' ARG . 0.1 OUTLIER 70.96 8.05 6.4 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.876 0.37 . . . . 0.0 110.844 -179.127 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 63.46 30.71 15.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.65 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 10' ' ' PRO . 46.5 m-20 37.22 94.07 0.05 OUTLIER Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.882 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 9' ' ' ASP . 9.8 Cg_endo -53.16 -54.0 5.77 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.499 2.132 . . . . 0.0 112.091 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.0 ttt85 -57.76 -41.76 82.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.52 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.408 ' HB3' ' CB ' ' A' ' 9' ' ' ASP . 3.6 tp-100 -60.47 -41.72 94.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.866 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.6 85.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.746 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -69.29 -39.69 78.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.919 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.1 t -70.96 -27.4 29.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.713 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.42 -54.18 6.29 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.768 -0.73 . . . . 0.0 111.845 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -61.95 -49.98 73.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.933 0.397 . . . . 0.0 110.69 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.32 -50.34 73.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.018 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.419 ' O ' ' CG1' ' A' ' 23' ' ' VAL . 87.2 m -67.48 -30.83 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.602 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.461 ' O ' HG23 ' A' ' 23' ' ' VAL . 37.7 t80 -60.48 -61.03 2.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.377 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.38 -41.75 93.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.939 0.4 . . . . 0.0 110.773 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -55.62 -53.46 56.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.493 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 20' ' ' PHE . 13.4 m -65.77 -49.6 76.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.677 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.441 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -55.05 -58.78 6.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.641 -179.8 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.89 -47.89 83.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.345 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.403 ' HG ' HD23 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -62.83 -42.62 99.8 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.428 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.405 ' CD2' ' O ' ' A' ' 23' ' ' VAL . 1.9 mm? -60.37 -55.6 31.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.808 0.337 . . . . 0.0 111.086 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.443 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 42.6 mt -61.81 -54.93 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.982 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.492 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 57.3 m80 -54.95 -38.82 68.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.666 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.473 ' O ' HD21 ' A' ' 33' ' ' LEU . 20.2 t80 -64.67 -33.09 75.12 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.436 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.7 tt -71.65 -46.25 63.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.796 0.332 . . . . 0.0 110.626 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 28' ' ' ILE . 4.0 mt -65.34 -54.51 27.94 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-O 121.157 0.503 . . . . 0.0 110.072 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.492 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -56.85 -40.15 75.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.12 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.453 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 19.9 t -62.24 -49.79 74.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.717 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.1 m -60.19 -46.12 90.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.091 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 5.4 tt0 -63.2 -43.66 97.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.87 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.03 -40.26 94.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.664 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.472 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.9 m-85 -61.0 -65.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.597 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.492 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-20 -59.37 -19.42 46.69 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.979 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.415 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 1.3 m0 -67.55 -71.41 0.21 Allowed 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -63.61 -15.8 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.092 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.492 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 18.5 tt0 -62.94 -68.94 0.3 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.639 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.464 ' O ' ' CB ' ' A' ' 44' ' ' ALA . . . -167.92 -59.6 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.374 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.464 ' CB ' ' O ' ' A' ' 43' ' ' GLY . . . 87.3 17.16 0.08 Allowed 'General case' 0 C--O 1.231 0.131 0 C-N-CA 122.647 0.379 . . . . 0.0 111.686 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.88 32.76 3.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.877 0.37 . . . . 0.0 110.521 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 p -149.52 -34.99 0.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.378 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -75.74 -61.37 0.91 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.031 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -70.0 105.89 1.61 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.467 2.111 . . . . 0.0 112.296 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.7 p -145.23 37.72 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.047 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 44.81 79.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.405 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 4.0 m -158.45 -75.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.529 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.5 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.911 -179.989 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.6 mmt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.632 0.253 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 29.6 m95 38.63 70.74 0.19 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.599 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 48.84 32.66 3.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 30.6 mm 50.88 54.08 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 6.5 m95 33.42 38.89 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.71 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 34.76 36.43 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.886 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 77.3 mt -85.06 -34.46 22.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.799 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -138.34 39.11 2.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -71.98 161.53 78.32 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.737 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.63 -51.13 1.99 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.565 2.176 . . . . 0.0 112.424 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -72.56 -48.93 36.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.129 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 -58.49 -52.77 64.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.136 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -62.78 -36.57 83.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 mt -66.63 -40.79 88.92 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.33 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.8 t -68.08 -23.75 29.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.165 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CD1' ' A' ' 20' ' ' PHE . . . -74.28 -48.37 14.84 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.372 179.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -61.93 -57.03 13.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.353 0.596 . . . . 0.0 110.09 179.28 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.24 -50.62 64.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.37 -179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.403 ' O ' ' CG1' ' A' ' 23' ' ' VAL . 81.2 m -66.82 -32.02 73.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.01 0.433 . . . . 0.0 110.683 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 16' ' ' GLY . 1.4 m-85 -60.06 -69.69 0.2 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.384 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.446 ' CD2' ' C ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -63.05 -32.41 73.78 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.822 -179.553 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.426 ' N ' ' CD1' ' A' ' 21' ' ' LEU . 37.9 t80 -59.26 -58.09 10.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.927 0.394 . . . . 0.0 110.614 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.475 ' CG2' ' N ' ' A' ' 24' ' ' LEU . 5.0 m -65.67 -52.15 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.388 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.475 ' N ' ' CG2' ' A' ' 23' ' ' VAL . 0.7 OUTLIER -51.91 -56.85 11.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.161 0.505 . . . . 0.0 111.159 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.71 71.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.897 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER -64.76 -51.85 60.1 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.354 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.421 ' N ' ' HG ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -66.28 -49.01 68.57 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 111.068 179.853 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.484 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.6 mp -60.66 -58.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.712 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.605 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 20.7 t-80 -54.46 -34.09 60.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.851 0.358 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.42 ' O ' HD22 ' A' ' 33' ' ' LEU . 82.2 t80 -63.9 -38.47 91.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.813 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.454 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.4 tp -72.23 -46.59 57.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.67 0.272 . . . . 0.0 111.253 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 28' ' ' ILE . 2.8 mt -64.5 -54.08 38.01 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.95 0.405 . . . . 0.0 110.421 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.605 ' HB3' ' O ' ' A' ' 29' ' ' HIS . 0.0 OUTLIER -57.42 -40.03 77.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.165 179.701 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.43 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 26.4 t -61.61 -56.7 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.148 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.7 m -60.58 -48.88 79.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 7.2 tt0 -62.46 -36.68 83.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.049 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -64.36 -45.26 88.54 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.956 0.408 . . . . 0.0 110.472 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.468 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.1 t80 -61.08 -60.99 2.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.179 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.502 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 85.5 m-20 -60.79 -18.93 58.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.025 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.413 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 0.8 OUTLIER -68.53 -70.15 0.28 Allowed 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.377 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 59.5 tp -63.5 -16.01 59.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.502 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 28.1 tt0 -63.77 -70.55 0.21 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.647 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.507 ' O ' ' N ' ' A' ' 47' ' ' LYS . . . -74.02 -3.91 65.96 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.994 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.89 -30.87 71.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.054 0.427 . . . . 0.0 110.985 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.0 m -75.53 0.58 16.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.096 -179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.2 p -146.8 -51.13 0.21 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.668 0.27 . . . . 0.0 111.404 -179.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.507 ' N ' ' O ' ' A' ' 43' ' ' GLY . 4.6 mttt 64.14 164.1 0.12 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.971 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -61.98 -57.8 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.557 2.171 . . . . 0.0 112.456 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.5 t -145.68 -54.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.249 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 77.02 134.31 0.06 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.841 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.1 m -80.42 82.17 6.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.881 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.901 179.984 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.845 0.355 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.496 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.23 -46.52 83.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.017 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.696 ' HA ' HD12 ' A' ' 17' ' ' LEU . 8.6 mt -66.86 -35.69 80.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.271 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.3 t -70.54 -27.36 30.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.535 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.68 -49.13 11.29 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.098 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -63.61 -57.77 9.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.566 0.698 . . . . 0.0 109.862 179.392 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.51 -48.67 68.79 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.745 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.744 ' O ' HG13 ' A' ' 23' ' ' VAL . 93.2 m -68.29 -37.55 80.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.404 ' O ' HG22 ' A' ' 23' ' ' VAL . 38.7 t80 -60.11 -52.68 64.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.355 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.758 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.5 pp -66.51 -49.15 67.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.909 0.385 . . . . 0.0 110.804 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.758 ' N ' HD12 ' A' ' 21' ' ' LEU . 7.7 t80 -54.18 -49.23 69.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.767 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.849 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 22.1 m -65.76 -48.56 81.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.618 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.888 ' CD1' HD11 ' A' ' 28' ' ' ILE . 0.3 OUTLIER -52.35 -65.04 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.98 0.419 . . . . 0.0 111.373 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.882 ' HA ' HD12 ' A' ' 28' ' ' ILE . . . -57.64 -31.74 66.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.182 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.596 HD11 ' CE2' ' A' ' 22' ' ' PHE . 11.3 mt -63.99 -49.44 72.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.644 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.849 ' HG ' ' O ' ' A' ' 23' ' ' VAL . 3.6 mt -62.83 -37.89 88.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.914 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.888 HD11 ' CD1' ' A' ' 24' ' ' LEU . 14.6 mt -63.12 -62.88 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.124 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.555 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 3.2 m170 -59.94 -38.6 82.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.032 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.458 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 25.6 t80 -64.66 -45.25 87.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.732 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.472 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.8 OUTLIER -68.71 -47.61 75.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.407 -179.591 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.776 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.3 pp -65.97 -47.71 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.936 0.398 . . . . 0.0 110.305 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.776 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -61.9 -45.47 93.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.401 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.456 ' N ' HD12 ' A' ' 33' ' ' LEU . 30.6 t -62.09 -55.27 30.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.414 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.1 m -62.43 -39.58 93.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -64.61 -57.69 8.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.24 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -37.41 87.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.143 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.502 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 85.9 t80 -61.49 -66.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.0 t-20 -57.84 -20.44 36.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.233 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -68.68 -70.68 0.25 Allowed 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -63.44 -17.34 62.59 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.591 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 46.0 tp10 . . . . . 0 N--CA 1.45 -0.466 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.539 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.791 0.329 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -63.6 -49.15 74.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.941 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.06 -36.15 82.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.285 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.1 t -67.83 -27.61 38.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.081 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.12 -42.53 35.94 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.829 -0.7 . . . . 0.0 111.55 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.526 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -63.7 -61.49 2.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.24 0.543 . . . . 0.0 110.368 179.25 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HA ' HD21 ' A' ' 21' ' ' LEU . . . -54.88 -45.56 74.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.897 -179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.734 ' O ' HG13 ' A' ' 23' ' ' VAL . 96.4 m -68.09 -42.68 79.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.718 0.294 . . . . 0.0 111.212 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -60.75 -49.37 77.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.48 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.2 pp -65.71 -50.66 64.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.858 0.361 . . . . 0.0 110.848 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.783 ' N ' HD12 ' A' ' 21' ' ' LEU . 2.0 t80 -55.48 -49.98 71.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.66 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.734 HG13 ' O ' ' A' ' 19' ' ' THR . 22.3 m -63.4 -50.61 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.68 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -59.46 -34.74 72.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.983 0.421 . . . . 0.0 110.18 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.68 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -62.06 -53.57 53.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.954 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 23' ' ' VAL . 1.3 pp -62.94 -33.62 75.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.82 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 23' ' ' VAL . 2.0 mm? -62.66 -48.41 79.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.831 0.348 . . . . 0.0 110.701 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.615 HG22 HD23 ' A' ' 32' ' ' LEU . 9.2 mt -63.45 -54.32 34.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.159 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.545 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 t60 -58.98 -40.05 83.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.994 0.426 . . . . 0.0 110.81 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.494 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 24.0 t80 -65.09 -44.48 88.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.5 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.475 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 2.5 tp -68.59 -47.88 74.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.081 -0.247 . . . . 0.0 111.294 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.3 pp -65.49 -48.72 71.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.851 0.358 . . . . 0.0 110.173 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.783 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -61.31 -41.71 97.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.206 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -62.79 -59.53 4.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.15 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.0 m -59.51 -48.18 82.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.505 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 2.6 pp20? -62.13 -43.52 98.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -66.58 -36.84 83.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.047 0.451 . . . . 0.0 110.473 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.524 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 10.7 t80 -61.81 -65.74 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.711 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.521 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 58.4 m-80 -57.63 -22.05 43.21 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.986 0.422 . . . . 0.0 111.13 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -67.44 -70.57 0.25 Allowed 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.519 ' C ' HD12 ' A' ' 41' ' ' LEU . 4.5 pp -64.41 -14.84 58.87 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.031 177.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.524 ' HB2' ' O ' ' A' ' 38' ' ' PHE . 2.2 tt0 . . . . . 0 N--CA 1.45 -0.464 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.508 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.582 ' OE1' ' HB2' ' A' ' 13' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.933 0.396 . . . . 0.0 111.465 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.582 ' HB2' ' OE1' ' A' ' 12' ' ' GLN . . . -60.87 -36.14 78.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.769 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.434 ' HG ' ' N ' ' A' ' 15' ' ' VAL . 0.6 OUTLIER -72.23 -41.34 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.619 0.247 . . . . 0.0 111.056 -179.654 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 12' ' ' GLN . 7.2 p -70.25 -26.57 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.592 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.76 -54.82 5.7 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.881 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.779 HD12 ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -63.12 -49.19 75.39 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.979 0.419 . . . . 0.0 110.91 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.779 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -59.59 -47.34 85.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.746 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.715 ' O ' HG13 ' A' ' 23' ' ' VAL . 81.7 m -66.6 -50.6 62.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.39 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -59.92 -44.51 94.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.738 0.304 . . . . 0.0 111.283 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.796 HD13 ' N ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -67.17 -54.81 17.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.967 0.413 . . . . 0.0 110.704 179.919 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.796 ' N ' HD13 ' A' ' 21' ' ' LEU . 65.9 t80 -53.82 -48.21 70.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.799 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.715 HG13 ' O ' ' A' ' 19' ' ' THR . 22.7 m -64.12 -49.31 81.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 111.661 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.552 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -58.27 -57.92 10.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.012 0.434 . . . . 0.0 111.265 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.5 73.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.815 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.547 HD12 ' C ' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -61.81 -37.35 84.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 0.0 110.891 -179.605 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 23' ' ' VAL . 1.9 mp -60.05 -56.52 20.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.604 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.0 mm -63.4 -28.7 45.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.809 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.533 ' O ' HD12 ' A' ' 33' ' ' LEU . 1.9 t-80 -62.79 -65.09 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.245 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 27' ' ' LEU . 2.3 p90 -62.43 -31.61 72.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.561 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.511 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.5 tp -69.59 -51.69 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.911 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.518 ' C ' HD12 ' A' ' 32' ' ' LEU . 2.0 pp -64.29 -41.39 96.9 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 29' ' ' HIS . 11.9 mt -60.32 -59.06 6.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.589 178.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.403 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 2.4 t -59.98 -28.11 67.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.189 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 m -66.09 -52.69 46.41 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.977 0.418 . . . . 0.0 110.536 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 40' ' ' TRP . 6.2 tt0 -62.41 -45.14 94.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.624 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.468 ' O ' HD12 ' A' ' 41' ' ' LEU . 7.9 mmt-85 -64.74 -36.23 83.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.504 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.548 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.9 m-85 -61.21 -66.35 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.386 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 11.9 m-80 -59.81 -18.77 46.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.845 0.355 . . . . 0.0 111.16 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.404 ' HB2' ' O ' ' A' ' 36' ' ' GLU . 72.8 t-105 -68.11 -74.91 0.11 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.793 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.895 HD13 ' N ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -63.19 -15.21 56.2 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.183 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.895 ' N ' HD13 ' A' ' 41' ' ' LEU . 4.7 tt0 . . . . . 0 N--CA 1.451 -0.409 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.291 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.84 0.352 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.483 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.11 -40.25 94.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.33 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 17' ' ' LEU . 12.3 mt -66.02 -43.6 87.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.608 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m -69.28 -22.01 25.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.624 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.41 -50.13 10.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.772 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -63.91 -55.73 20.49 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.643 0.735 . . . . 0.0 109.558 178.99 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.563 ' HA ' HD21 ' A' ' 21' ' ' LEU . . . -54.13 -38.28 65.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.528 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.754 ' O ' HG13 ' A' ' 23' ' ' VAL . 4.5 m -67.61 -42.87 81.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.828 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.431 ' O ' HG22 ' A' ' 23' ' ' VAL . 18.4 t80 -60.76 -51.84 67.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.089 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.745 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.6 pp -66.31 -47.73 72.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.611 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.745 ' N ' HD12 ' A' ' 21' ' ' LEU . 75.9 t80 -55.71 -48.61 74.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.766 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.754 HG13 ' O ' ' A' ' 19' ' ' THR . 25.3 m -65.24 -49.03 81.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.814 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.862 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -59.16 -44.81 92.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.913 0.387 . . . . 0.0 110.569 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.862 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -61.18 -56.82 16.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.238 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.84 -28.67 70.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.752 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.665 HD13 ' O ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -63.48 -60.43 3.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.736 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.513 HG22 HD23 ' A' ' 32' ' ' LEU . 5.1 mt -62.77 -44.98 99.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.621 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 39.8 m170 -60.23 -42.56 95.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.849 ' HA ' HD22 ' A' ' 33' ' ' LEU . 19.5 t80 -64.63 -38.38 90.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.591 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.469 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -70.38 -47.83 63.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.03 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.794 HD12 ' N ' ' A' ' 33' ' ' LEU . 3.3 pp -65.23 -51.51 60.49 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.892 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -59.4 -40.08 85.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.272 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.892 ' N ' HD23 ' A' ' 33' ' ' LEU . 27.4 t -61.51 -49.99 74.52 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.58 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.4 m -59.39 -44.17 92.84 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.63 -49.6 74.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -64.9 -32.31 73.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.486 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.516 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.7 m-85 -62.19 -63.97 1.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.442 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.528 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-80 -58.67 -21.68 54.91 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 110.983 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -70.49 0.25 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.12 -15.41 56.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 13.3 tp10 . . . . . 0 N--CA 1.451 -0.412 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.709 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.596 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.974 0.416 . . . . 0.0 110.979 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.11 70.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.08 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.1 mt -69.94 -44.8 68.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.767 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 12' ' ' GLN . 10.6 p -68.91 -27.08 34.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -73.48 -55.27 6.18 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.746 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -61.69 -47.88 83.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.062 0.458 . . . . 0.0 110.51 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.78 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -58.42 -37.51 75.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.369 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.709 ' O ' HG13 ' A' ' 23' ' ' VAL . 19.0 m -67.08 -55.3 14.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.028 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -59.63 -44.33 93.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.334 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.894 HD23 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.03 -57.77 6.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.894 ' N ' HD23 ' A' ' 21' ' ' LEU . 72.5 t80 -50.63 -49.12 57.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.77 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.709 HG13 ' O ' ' A' ' 19' ' ' THR . 19.4 m -64.16 -50.28 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.737 0.303 . . . . 0.0 111.525 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.9 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 10.5 tp -52.83 -65.28 0.59 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 111.072 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.63 -22.93 25.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.576 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.708 HD23 ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -66.34 -53.44 36.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 179.152 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.9 ' HG ' ' O ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -63.11 -46.9 85.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 110.551 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.695 HD13 HD12 ' A' ' 27' ' ' LEU . 39.3 mm -63.6 -61.33 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.968 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.439 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 25.1 t-80 -55.11 -43.18 73.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.218 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.869 ' HA ' HD22 ' A' ' 33' ' ' LEU . 57.0 t80 -61.52 -31.56 71.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.057 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.657 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.4 tt -72.87 -47.23 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.827 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.657 HD23 ' CG2' ' A' ' 31' ' ' ILE . 4.1 mt -64.75 -54.24 34.57 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.15 0.5 . . . . 0.0 110.017 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.875 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -56.35 -39.02 72.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.957 179.449 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.875 ' N ' HD23 ' A' ' 33' ' ' LEU . 3.6 m -60.72 -51.04 71.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.0 m -62.82 -38.1 89.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.747 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -63.83 -45.7 88.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.706 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -36.82 85.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.452 . . . . 0.0 110.39 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.411 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.6 m-85 -61.4 -64.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.626 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 11.4 m-20 -60.77 -18.1 52.99 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.234 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -69.75 -73.68 0.15 Allowed 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.757 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.76 -16.71 58.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.195 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.626 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 6.7 mm-40 . . . . . 0 N--CA 1.45 -0.474 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.675 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.792 0.33 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.493 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.19 -46.08 85.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.113 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.13 -34.23 77.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.404 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.3 t -68.21 -28.72 41.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.149 179.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.34 -43.41 31.48 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.617 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.538 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -63.3 -61.04 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.236 0.541 . . . . 0.0 110.424 179.416 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.86 -47.83 76.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.075 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.609 ' O ' HG13 ' A' ' 23' ' ' VAL . 89.7 m -66.0 -51.24 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.685 0.279 . . . . 0.0 111.29 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -59.61 -35.53 74.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.861 HD23 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.78 -61.26 1.96 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.678 179.655 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.861 ' N ' HD23 ' A' ' 21' ' ' LEU . 25.7 t80 -54.02 -44.22 70.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.986 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.609 HG13 ' O ' ' A' ' 19' ' ' THR . 29.2 m -65.2 -49.21 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.824 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.2 OUTLIER -60.49 -45.25 94.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.893 0.378 . . . . 0.0 110.719 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.824 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -59.99 -39.75 86.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.794 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.547 HD11 ' CE2' ' A' ' 22' ' ' PHE . 23.1 mt -64.38 -41.57 96.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.736 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 23' ' ' VAL . 6.3 mp -63.09 -57.46 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.077 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.696 HD12 ' N ' ' A' ' 29' ' ' HIS . 2.2 pp -60.75 -50.98 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.201 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.696 ' N ' HD12 ' A' ' 28' ' ' ILE . 32.4 t-80 -56.78 -38.1 72.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.909 0.385 . . . . 0.0 110.456 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.871 ' HA ' HD22 ' A' ' 33' ' ' LEU . 43.5 t80 -64.7 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.892 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.661 ' CG2' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -71.24 -45.59 69.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.82 0.343 . . . . 0.0 110.651 179.676 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.661 HD23 ' CG2' ' A' ' 31' ' ' ILE . 3.7 mt -65.67 -53.99 33.68 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.08 0.467 . . . . 0.0 110.091 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.912 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -57.81 -40.99 81.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.228 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.912 ' N ' HD23 ' A' ' 33' ' ' LEU . 65.2 p -62.66 -49.79 73.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.722 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.9 m -61.77 -41.07 97.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.112 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.71 -53.22 54.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.92 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -63.85 -35.03 79.29 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.597 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 51.2 t80 -60.02 -66.3 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.429 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.649 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 13.4 m-80 -59.67 -17.55 34.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.034 0.445 . . . . 0.0 111.033 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -68.27 -75.98 0.1 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.819 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.409 ' C ' HD12 ' A' ' 41' ' ' LEU . 4.2 pp -62.92 -16.18 58.15 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.362 178.255 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.649 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 2.3 mm-40 . . . . . 0 N--CA 1.45 -0.472 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.806 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.851 0.358 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.17 -33.14 74.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.042 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -69.74 -39.76 76.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 40.7 t -69.62 -28.35 37.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.674 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.05 -56.41 5.3 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.619 -0.801 . . . . 0.0 111.598 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.727 HD12 ' N ' ' A' ' 18' ' ' ALA . 2.6 pp -62.57 -48.68 78.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.724 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.727 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -57.27 -47.47 81.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.26 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.779 ' O ' HG13 ' A' ' 23' ' ' VAL . 66.6 m -66.15 -34.71 78.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.623 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.43 ' O ' HG22 ' A' ' 23' ' ' VAL . 1.5 t80 -60.95 -55.68 30.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.111 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.6 pp -66.96 -42.78 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 0.0 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -56.46 -51.21 69.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.415 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.779 HG13 ' O ' ' A' ' 19' ' ' THR . 17.3 m -64.92 -50.16 76.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.479 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.545 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -55.6 -60.57 3.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.074 0.464 . . . . 0.0 110.952 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.476 ' HA ' HD11 ' A' ' 28' ' ' ILE . . . -58.39 -32.65 68.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.992 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.4 mt -65.1 -46.69 80.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.913 0.387 . . . . 0.0 110.627 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 23' ' ' VAL . 8.4 mp -62.2 -55.46 28.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.157 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 25' ' ' ALA . 16.6 pt -62.01 -45.89 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-O 120.8 0.333 . . . . 0.0 111.211 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.451 ' HA ' HD21 ' A' ' 32' ' ' LEU . 54.2 t60 -61.97 -36.71 82.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.649 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.28 -42.37 88.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.294 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.512 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -66.69 -50.06 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.319 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.642 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.4 pp -62.46 -26.67 68.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.642 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -61.3 -65.61 0.67 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.436 178.168 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.41 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 11.7 m -59.37 -19.08 44.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.194 178.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.8 m -72.66 -63.14 1.22 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.98 0.419 . . . . 0.0 110.786 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.79 -39.06 87.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -36.47 84.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.05 0.452 . . . . 0.0 109.984 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.41 ' CD1' ' O ' ' A' ' 34' ' ' SER . 1.4 m-85 -62.25 -63.26 1.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.261 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.621 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 0.7 OUTLIER -61.15 -18.77 59.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.207 179.657 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 11.9 t-105 -69.98 -72.7 0.18 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.83 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.5 tt -62.43 -17.26 58.88 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.164 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.621 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 10.9 mt-10 . . . . . 0 N--CA 1.448 -0.53 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.537 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.954 0.407 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.3 -43.53 90.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.527 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.2 mt -67.5 -46.08 73.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.024 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.0 -24.26 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.245 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.52 -56.6 4.98 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.998 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.91 -54.78 29.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.744 0.783 . . . . 0.0 109.856 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.83 -53.81 43.26 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.389 -1.278 . . . . 0.0 112.068 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.729 ' O ' HG13 ' A' ' 23' ' ' VAL . 47.9 m -66.56 -38.25 86.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.605 0.241 . . . . 0.0 111.311 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -59.86 -54.82 41.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.853 0.359 . . . . 0.0 111.261 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.756 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.6 pp -65.72 -48.0 73.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.979 0.419 . . . . 0.0 110.751 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.756 ' N ' HD12 ' A' ' 21' ' ' LEU . 4.2 m-85 -53.53 -55.83 22.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.478 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.729 HG13 ' O ' ' A' ' 19' ' ' THR . 17.9 m -60.28 -48.04 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.821 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.534 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -52.03 -67.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.949 0.404 . . . . 0.0 110.845 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.07 -24.75 64.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.995 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 HD22 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -65.22 -54.21 32.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.45 179.702 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.823 HD22 HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -62.88 -44.61 95.64 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.948 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.601 HG22 HD23 ' A' ' 32' ' ' LEU . 38.2 mm -62.9 -57.06 13.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.198 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.771 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 m-70 -61.41 -39.59 91.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.322 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.576 ' O ' HD23 ' A' ' 33' ' ' LEU . 68.8 t80 -60.78 -51.41 69.47 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.725 HD12 ' N ' ' A' ' 32' ' ' LEU . 2.2 pp -67.8 -50.61 58.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.798 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.5 pp -60.32 -51.32 70.04 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.672 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.798 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -62.73 -51.23 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.758 0.314 . . . . 0.0 110.355 179.349 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.72 ' H ' HD23 ' A' ' 33' ' ' LEU . 68.6 m -61.91 -70.8 0.17 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.3 m -43.03 -42.2 3.76 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.801 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -63.03 -47.94 80.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.993 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -35.48 81.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.65 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 4.7 m-85 -62.0 -66.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.636 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.53 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 44.1 m-20 -58.96 -20.19 50.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.127 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 27.6 t90 -67.99 -70.96 0.23 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.6 -16.11 59.98 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.007 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 1.6 tp10 . . . . . 0 N--CA 1.449 -0.476 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.5 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.899 0.38 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.6 85.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.746 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.443 ' C ' HD12 ' A' ' 14' ' ' LEU . 1.0 OUTLIER -69.29 -39.69 78.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.919 -179.514 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.1 t -70.96 -27.4 29.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.713 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.42 -54.18 6.29 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.768 -0.73 . . . . 0.0 111.845 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 18' ' ' ALA . 2.7 pp -61.95 -49.98 73.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.933 0.397 . . . . 0.0 110.69 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.783 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -57.32 -50.34 73.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.018 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.782 ' O ' HG13 ' A' ' 23' ' ' VAL . 87.2 m -67.48 -30.83 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.602 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -60.48 -61.03 2.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.377 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -65.38 -41.75 93.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.939 0.4 . . . . 0.0 110.773 -179.84 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.414 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 2.4 m-85 -55.62 -53.46 56.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.493 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.782 HG13 ' O ' ' A' ' 19' ' ' THR . 13.4 m -65.77 -49.6 76.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.677 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.546 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -55.05 -58.78 6.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.641 -179.8 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.89 -47.89 83.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.345 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.554 HD12 ' C ' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -62.83 -42.62 99.8 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.428 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 23' ' ' VAL . 1.9 mm? -60.37 -55.6 31.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.808 0.337 . . . . 0.0 111.086 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.454 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 42.6 mt -61.81 -54.93 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.982 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.499 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 57.3 m80 -54.95 -38.82 68.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.666 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.87 ' HA ' HD22 ' A' ' 33' ' ' LEU . 20.2 t80 -64.67 -33.09 75.12 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.664 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.7 tt -71.65 -46.25 63.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.796 0.332 . . . . 0.0 110.626 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.664 HD23 ' CG2' ' A' ' 31' ' ' ILE . 4.0 mt -65.34 -54.51 27.94 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-O 121.157 0.503 . . . . 0.0 110.072 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.902 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -56.85 -40.15 75.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.12 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.902 ' N ' HD23 ' A' ' 33' ' ' LEU . 19.9 t -62.24 -49.79 74.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.717 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.1 m -60.19 -46.12 90.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.091 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 5.4 tt0 -63.2 -43.66 97.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.87 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.03 -40.26 94.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.664 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.49 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.9 m-85 -61.0 -65.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.597 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.528 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-20 -59.37 -19.42 46.69 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.979 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.415 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 1.3 m0 -67.55 -71.41 0.21 Allowed 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -63.61 -15.8 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.092 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 18.5 tt0 . . . . . 0 N--CA 1.449 -0.497 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.639 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.801 0.334 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.513 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -62.78 -36.57 83.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 mt -66.63 -40.79 88.92 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.33 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.8 t -68.08 -23.75 29.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.165 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CD1' ' A' ' 20' ' ' PHE . . . -74.28 -48.37 14.84 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.372 179.136 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -61.93 -57.03 13.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.353 0.596 . . . . 0.0 110.09 179.28 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.476 ' O ' HD13 ' A' ' 21' ' ' LEU . . . -53.24 -50.62 64.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.37 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.806 ' O ' HG13 ' A' ' 23' ' ' VAL . 81.2 m -66.82 -32.02 73.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.01 0.433 . . . . 0.0 110.683 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 16' ' ' GLY . 1.4 m-85 -60.06 -69.69 0.2 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.384 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.87 HD13 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -63.05 -32.41 73.78 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.822 -179.553 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.87 ' N ' HD13 ' A' ' 21' ' ' LEU . 37.9 t80 -59.26 -58.09 10.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.927 0.394 . . . . 0.0 110.614 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.838 ' HA ' HD23 ' A' ' 26' ' ' LEU . 5.0 m -65.67 -52.15 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.388 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.669 HD13 HD13 ' A' ' 28' ' ' ILE . 0.7 OUTLIER -51.91 -56.85 11.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.161 0.505 . . . . 0.0 111.159 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.71 71.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.897 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.838 HD23 ' HA ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER -64.76 -51.85 60.1 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.354 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.892 HD12 ' CD1' ' A' ' 28' ' ' ILE . 0.0 OUTLIER -66.28 -49.01 68.57 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 111.068 179.853 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.892 ' CD1' HD12 ' A' ' 27' ' ' LEU . 1.6 mp -60.66 -58.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.712 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.612 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 20.7 t-80 -54.46 -34.09 60.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.851 0.358 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.853 ' HA ' HD22 ' A' ' 33' ' ' LEU . 82.2 t80 -63.9 -38.47 91.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.813 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.68 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.4 tp -72.23 -46.59 57.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.67 0.272 . . . . 0.0 111.253 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.68 HD23 ' CG2' ' A' ' 31' ' ' ILE . 2.8 mt -64.5 -54.08 38.01 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.95 0.405 . . . . 0.0 110.421 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.853 HD22 ' HA ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -57.42 -40.03 77.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.165 179.701 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.847 ' N ' HD23 ' A' ' 33' ' ' LEU . 26.4 t -61.61 -56.7 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.148 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.7 m -60.58 -48.88 79.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 7.2 tt0 -62.46 -36.68 83.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.049 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -64.36 -45.26 88.54 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.956 0.408 . . . . 0.0 110.472 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.491 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.1 t80 -61.08 -60.99 2.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.179 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.539 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 85.5 m-20 -60.79 -18.93 58.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.025 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.413 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 0.8 OUTLIER -68.53 -70.15 0.28 Allowed 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.377 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 59.5 tp -63.5 -16.01 59.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.539 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 28.1 tt0 . . . . . 0 N--CA 1.45 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.647 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.0 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.768 0.318 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 44.8 29.47 0.44 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.627 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.2 mtt180 45.27 29.76 0.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.561 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.525 ' O ' HG22 ' A' ' 4' ' ' ILE . 25.2 mm 50.61 47.67 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.208 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.447 ' CD1' ' N ' ' A' ' 5' ' ' TRP . 7.3 m95 33.89 37.58 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.773 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.01 36.83 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.931 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 48.1 mt -85.11 -68.47 0.72 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.626 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -140.41 81.36 1.8 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.761 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.454 ' CB ' ' HD3' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -167.02 -56.27 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.336 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.454 ' HD3' ' CB ' ' A' ' 9' ' ' ASP . 51.4 Cg_exo -55.55 -58.89 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.229 1.953 . . . . 0.0 112.354 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.859 ' O ' HG23 ' A' ' 15' ' ' VAL . 8.4 ptm180 -57.06 -49.58 75.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.028 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -59.39 -36.13 75.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.855 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.496 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.23 -46.52 83.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.017 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.696 ' HA ' HD12 ' A' ' 17' ' ' LEU . 8.6 mt -66.86 -35.69 80.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.271 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.859 HG23 ' O ' ' A' ' 11' ' ' ARG . 26.3 t -70.54 -27.36 30.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.535 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.68 -49.13 11.29 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.098 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -63.61 -57.77 9.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.566 0.698 . . . . 0.0 109.862 179.392 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.51 -48.67 68.79 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.745 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.744 ' O ' HG13 ' A' ' 23' ' ' VAL . 93.2 m -68.29 -37.55 80.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.404 ' O ' HG22 ' A' ' 23' ' ' VAL . 38.7 t80 -60.11 -52.68 64.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.355 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.758 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.5 pp -66.51 -49.15 67.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.909 0.385 . . . . 0.0 110.804 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.758 ' N ' HD12 ' A' ' 21' ' ' LEU . 7.7 t80 -54.18 -49.23 69.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.767 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.849 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 22.1 m -65.76 -48.56 81.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.618 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.888 ' CD1' HD11 ' A' ' 28' ' ' ILE . 0.3 OUTLIER -52.35 -65.04 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.98 0.419 . . . . 0.0 111.373 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.882 ' HA ' HD12 ' A' ' 28' ' ' ILE . . . -57.64 -31.74 66.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.182 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.596 HD11 ' CE2' ' A' ' 22' ' ' PHE . 11.3 mt -63.99 -49.44 72.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.644 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.849 ' HG ' ' O ' ' A' ' 23' ' ' VAL . 3.6 mt -62.83 -37.89 88.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.914 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.888 HD11 ' CD1' ' A' ' 24' ' ' LEU . 14.6 mt -63.12 -62.88 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.124 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.555 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 3.2 m170 -59.94 -38.6 82.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.032 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.458 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 25.6 t80 -64.66 -45.25 87.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.732 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.472 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.8 OUTLIER -68.71 -47.61 75.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.407 -179.591 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.776 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.3 pp -65.97 -47.71 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.936 0.398 . . . . 0.0 110.305 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.776 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -61.9 -45.47 93.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.401 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.456 ' N ' HD12 ' A' ' 33' ' ' LEU . 30.6 t -62.09 -55.27 30.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.414 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.1 m -62.43 -39.58 93.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -64.61 -57.69 8.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.24 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -37.41 87.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.143 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.502 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 85.9 t80 -61.49 -66.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.0 t-20 -57.84 -20.44 36.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.233 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -68.68 -70.68 0.25 Allowed 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -63.44 -17.34 62.59 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.591 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 46.0 tp10 -63.45 -53.44 52.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.539 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.03 112.34 1.67 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.384 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.425 ' O ' ' CB ' ' A' ' 45' ' ' SER . . . -172.11 74.25 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.846 0.355 . . . . 0.0 110.753 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' 44' ' ' ALA . 0.8 OUTLIER 83.42 26.92 0.1 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.863 -179.732 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.5 p -149.28 -57.78 0.2 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.948 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.53 -60.32 0.62 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.89 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.36 76.92 3.73 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.561 2.174 . . . . 0.0 112.439 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.429 ' O ' ' N ' ' A' ' 51' ' ' THR . 3.0 m -94.5 126.24 46.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.178 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.453 ' O ' HG23 ' A' ' 51' ' ' THR . 1.4 pt20 41.78 -91.04 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.681 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -159.78 125.42 4.17 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.818 0.342 . . . . 0.0 110.849 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.898 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.746 0.308 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 2.6 m-90 38.89 34.07 0.09 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.673 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.734 ' HB3' HD12 ' A' ' 7' ' ' LEU . 14.1 mtp85 52.37 57.5 6.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.922 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.659 ' O ' HG22 ' A' ' 4' ' ' ILE . 4.1 mp 46.89 28.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.201 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 35.12 32.86 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.811 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.416 ' N ' ' O ' ' A' ' 4' ' ' ILE . 4.1 mt-30 -171.59 20.19 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.734 HD12 ' HB3' ' A' ' 3' ' ' ARG . 13.0 mt -83.16 -59.13 2.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.035 0.445 . . . . 0.0 110.502 179.502 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -138.06 83.12 1.95 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.747 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.429 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -164.52 -64.49 0.01 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.836 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 9' ' ' ASP . 10.7 Cg_endo -53.87 -53.47 6.37 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.506 2.137 . . . . 0.0 112.187 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.717 ' O ' HG23 ' A' ' 15' ' ' VAL . 38.1 ttp85 -55.38 -56.02 24.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.821 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -59.21 -30.73 68.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.738 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -63.6 -49.15 74.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.941 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.06 -36.15 82.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.285 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.717 HG23 ' O ' ' A' ' 11' ' ' ARG . 38.1 t -67.83 -27.61 38.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.081 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.12 -42.53 35.94 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.829 -0.7 . . . . 0.0 111.55 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.526 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -63.7 -61.49 2.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.24 0.543 . . . . 0.0 110.368 179.25 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HA ' HD21 ' A' ' 21' ' ' LEU . . . -54.88 -45.56 74.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.897 -179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.734 ' O ' HG13 ' A' ' 23' ' ' VAL . 96.4 m -68.09 -42.68 79.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.718 0.294 . . . . 0.0 111.212 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -60.75 -49.37 77.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.48 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.2 pp -65.71 -50.66 64.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.858 0.361 . . . . 0.0 110.848 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.783 ' N ' HD12 ' A' ' 21' ' ' LEU . 2.0 t80 -55.48 -49.98 71.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.66 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.734 HG13 ' O ' ' A' ' 19' ' ' THR . 22.3 m -63.4 -50.61 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.68 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -59.46 -34.74 72.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.983 0.421 . . . . 0.0 110.18 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.68 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -62.06 -53.57 53.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.954 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 23' ' ' VAL . 1.3 pp -62.94 -33.62 75.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.82 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 23' ' ' VAL . 2.0 mm? -62.66 -48.41 79.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.831 0.348 . . . . 0.0 110.701 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.615 HG22 HD23 ' A' ' 32' ' ' LEU . 9.2 mt -63.45 -54.32 34.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.159 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.545 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 t60 -58.98 -40.05 83.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.994 0.426 . . . . 0.0 110.81 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.494 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 24.0 t80 -65.09 -44.48 88.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.5 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.475 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 2.5 tp -68.59 -47.88 74.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.081 -0.247 . . . . 0.0 111.294 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.3 pp -65.49 -48.72 71.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.851 0.358 . . . . 0.0 110.173 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.783 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -61.31 -41.71 97.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.206 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -62.79 -59.53 4.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.15 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.0 m -59.51 -48.18 82.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.505 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 2.6 pp20? -62.13 -43.52 98.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -66.58 -36.84 83.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.047 0.451 . . . . 0.0 110.473 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.524 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 10.7 t80 -61.81 -65.74 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.711 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.521 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 58.4 m-80 -57.63 -22.05 43.21 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.986 0.422 . . . . 0.0 111.13 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -67.44 -70.57 0.25 Allowed 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.519 ' C ' HD12 ' A' ' 41' ' ' LEU . 4.5 pp -64.41 -14.84 58.87 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.031 177.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.524 ' HB2' ' O ' ' A' ' 38' ' ' PHE . 2.2 tt0 -63.4 -67.22 0.44 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.508 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.469 ' O ' ' N ' ' A' ' 45' ' ' SER . . . -167.82 -66.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.541 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 39.89 -86.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 43' ' ' GLY . 16.1 p -70.69 -28.58 64.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.653 0.263 . . . . 0.0 111.413 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.4 p -87.05 -13.84 43.22 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.261 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.655 ' O ' HG23 ' A' ' 49' ' ' VAL . 10.9 tttt -77.25 142.67 68.2 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.665 0.269 . . . . 0.0 110.764 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.63 128.07 26.78 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.546 2.164 . . . . 0.0 112.388 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 47' ' ' LYS . 21.6 t -142.64 -48.4 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.963 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -164.24 84.34 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.884 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 26.2 p 52.46 86.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.101 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.1 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.291 -0.861 . . . . 0.0 110.887 -179.999 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 ptt? . . . . . 0 N--CA 1.488 1.433 0 CA-C-O 120.626 0.251 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.418 ' CD1' ' HG2' ' A' ' 10' ' ' PRO . 1.5 t-105 40.08 65.75 0.7 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.7 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 52.7 25.49 3.81 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.113 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.463 ' O ' HG22 ' A' ' 4' ' ' ILE . 11.3 mm 44.17 30.3 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.209 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.413 ' C ' ' O ' ' A' ' 4' ' ' ILE . 19.8 m95 32.55 51.23 0.23 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.521 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -171.75 -30.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.872 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 24.2 mt -81.41 -50.57 9.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.735 0.302 . . . . 0.0 110.963 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -103.49 -39.36 6.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.892 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 78.69 69.27 0.18 Allowed Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.839 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.434 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 32.2 Cg_exo -58.45 -38.01 92.1 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.693 2.262 . . . . 0.0 112.526 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.633 ' HA ' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -54.83 -66.16 0.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.567 -179.589 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.582 ' OE1' ' HB2' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -58.36 -45.05 88.95 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.933 0.396 . . . . 0.0 111.465 -179.528 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.582 ' HB2' ' OE1' ' A' ' 12' ' ' GLN . . . -60.87 -36.14 78.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.769 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.633 HD23 ' HA ' ' A' ' 11' ' ' ARG . 0.6 OUTLIER -72.23 -41.34 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.619 0.247 . . . . 0.0 111.056 -179.654 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 12' ' ' GLN . 7.2 p -70.25 -26.57 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.592 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.76 -54.82 5.7 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.881 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.779 HD12 ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -63.12 -49.19 75.39 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.979 0.419 . . . . 0.0 110.91 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.779 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -59.59 -47.34 85.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.746 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.715 ' O ' HG13 ' A' ' 23' ' ' VAL . 81.7 m -66.6 -50.6 62.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.39 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -59.92 -44.51 94.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.738 0.304 . . . . 0.0 111.283 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.796 HD13 ' N ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -67.17 -54.81 17.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.967 0.413 . . . . 0.0 110.704 179.919 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.796 ' N ' HD13 ' A' ' 21' ' ' LEU . 65.9 t80 -53.82 -48.21 70.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.799 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.715 HG13 ' O ' ' A' ' 19' ' ' THR . 22.7 m -64.12 -49.31 81.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 111.661 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.552 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -58.27 -57.92 10.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.012 0.434 . . . . 0.0 111.265 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.5 73.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.815 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.547 HD12 ' C ' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -61.81 -37.35 84.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 0.0 110.891 -179.605 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 23' ' ' VAL . 1.9 mp -60.05 -56.52 20.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.604 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.0 mm -63.4 -28.7 45.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.809 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.533 ' O ' HD12 ' A' ' 33' ' ' LEU . 1.9 t-80 -62.79 -65.09 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.245 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 27' ' ' LEU . 2.3 p90 -62.43 -31.61 72.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.561 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.511 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.5 tp -69.59 -51.69 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.911 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.518 ' C ' HD12 ' A' ' 32' ' ' LEU . 2.0 pp -64.29 -41.39 96.9 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 29' ' ' HIS . 11.9 mt -60.32 -59.06 6.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.589 178.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.403 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 2.4 t -59.98 -28.11 67.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.189 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 m -66.09 -52.69 46.41 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.977 0.418 . . . . 0.0 110.536 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 40' ' ' TRP . 6.2 tt0 -62.41 -45.14 94.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.624 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.468 ' O ' HD12 ' A' ' 41' ' ' LEU . 7.9 mmt-85 -64.74 -36.23 83.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.504 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.548 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.9 m-85 -61.21 -66.35 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.386 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 11.9 m-80 -59.81 -18.77 46.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.845 0.355 . . . . 0.0 111.16 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.404 ' HB2' ' O ' ' A' ' 36' ' ' GLU . 72.8 t-105 -68.11 -74.91 0.11 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.793 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.895 HD13 ' N ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -63.19 -15.21 56.2 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.183 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.895 ' N ' HD13 ' A' ' 41' ' ' LEU . 4.7 tt0 -63.07 -63.33 1.23 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.291 179.354 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 89.66 46.02 4.41 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.505 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.5 -47.29 73.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.819 0.342 . . . . 0.0 111.088 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -31.77 66.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.957 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.8 p -87.78 -74.04 0.46 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.958 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 4.5 tttt 72.7 146.6 0.12 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.787 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.403 ' O ' ' N ' ' A' ' 50' ' ' GLN . 57.0 Cg_endo -70.86 130.58 18.2 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.535 2.157 . . . . 0.0 112.313 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.7 t 62.74 -77.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.181 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' A' ' 48' ' ' PRO . 4.3 tt0 76.13 153.83 0.15 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.866 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.7 m -80.22 -65.4 1.01 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.886 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.579 ' O ' ' N ' ' A' ' 3' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.531 0.205 . . . . 0.0 111.097 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.632 ' O ' HD21 ' A' ' 7' ' ' LEU . 0.0 OUTLIER 47.38 -77.79 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.301 179.576 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.579 ' N ' ' O ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -69.16 -8.72 48.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.427 -179.282 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.426 ' CD1' ' HA ' ' A' ' 1' ' ' MET . 35.3 pt -72.91 -21.95 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.506 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 1.0 OUTLIER -68.28 -12.92 61.81 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.357 178.473 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.506 ' CB ' ' O ' ' A' ' 5' ' ' TRP . 1.9 tt0 90.7 87.4 0.01 OUTLIER 'General case' 0 C--N 1.342 0.274 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.785 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.632 HD21 ' O ' ' A' ' 2' ' ' TRP . 0.1 OUTLIER -154.78 -42.42 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.024 -179.845 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -133.62 32.35 3.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.893 0.377 . . . . 0.0 110.913 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.3 p30 -72.39 162.25 74.84 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.807 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -48.37 -46.87 21.81 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.665 2.244 . . . . 0.0 112.718 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.48 -50.95 66.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.086 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.2 tm0? -59.32 -39.59 83.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.759 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.483 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.11 -40.25 94.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.33 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 17' ' ' LEU . 12.3 mt -66.02 -43.6 87.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.608 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m -69.28 -22.01 25.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.624 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.41 -50.13 10.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.772 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -63.91 -55.73 20.49 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.643 0.735 . . . . 0.0 109.558 178.99 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.563 ' HA ' HD21 ' A' ' 21' ' ' LEU . . . -54.13 -38.28 65.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.528 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.754 ' O ' HG13 ' A' ' 23' ' ' VAL . 4.5 m -67.61 -42.87 81.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.828 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.431 ' O ' HG22 ' A' ' 23' ' ' VAL . 18.4 t80 -60.76 -51.84 67.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.089 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.745 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.6 pp -66.31 -47.73 72.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.611 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.745 ' N ' HD12 ' A' ' 21' ' ' LEU . 75.9 t80 -55.71 -48.61 74.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.766 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.754 HG13 ' O ' ' A' ' 19' ' ' THR . 25.3 m -65.24 -49.03 81.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.814 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.862 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -59.16 -44.81 92.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.913 0.387 . . . . 0.0 110.569 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.862 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -61.18 -56.82 16.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.238 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.84 -28.67 70.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.752 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.665 HD13 ' O ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -63.48 -60.43 3.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.736 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.513 HG22 HD23 ' A' ' 32' ' ' LEU . 5.1 mt -62.77 -44.98 99.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.621 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 39.8 m170 -60.23 -42.56 95.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.849 ' HA ' HD22 ' A' ' 33' ' ' LEU . 19.5 t80 -64.63 -38.38 90.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.591 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.469 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -70.38 -47.83 63.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.03 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.794 HD12 ' N ' ' A' ' 33' ' ' LEU . 3.3 pp -65.23 -51.51 60.49 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.892 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -59.4 -40.08 85.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.272 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.892 ' N ' HD23 ' A' ' 33' ' ' LEU . 27.4 t -61.51 -49.99 74.52 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.58 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.4 m -59.39 -44.17 92.84 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.63 -49.6 74.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -64.9 -32.31 73.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.486 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.516 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.7 m-85 -62.19 -63.97 1.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.442 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.528 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-80 -58.67 -21.68 54.91 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 110.983 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.418 ' CD1' ' HB2' ' A' ' 45' ' ' SER . 0.0 OUTLIER -67.55 -70.49 0.25 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.288 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.12 -15.41 56.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 13.3 tp10 -63.88 -50.97 66.69 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.709 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -167.18 -31.94 0.02 OUTLIER Glycine 0 C--N 1.333 0.362 0 C-N-CA 120.333 -0.937 . . . . 0.0 113.288 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.21 -45.25 89.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.859 0.329 . . . . 0.0 111.323 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.418 ' HB2' ' CD1' ' A' ' 40' ' ' TRP . 4.5 t -72.19 -25.75 61.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.177 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.9 p -86.84 -24.96 24.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.071 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.651 ' HD2' HG22 ' A' ' 51' ' ' THR . 12.4 mtmm -161.44 72.14 2.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.756 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.31 -44.44 0.55 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.523 2.149 . . . . 0.0 112.259 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.553 HG12 ' HG3' ' A' ' 50' ' ' GLN . 20.6 t -145.32 133.32 16.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.553 ' HG3' HG12 ' A' ' 49' ' ' VAL . 2.3 mt-30 45.13 38.66 3.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.407 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.651 HG22 ' HD2' ' A' ' 47' ' ' LYS . 11.0 p 53.48 55.52 8.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.044 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.82 -179.968 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 ptp . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.73 0.3 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.7 m95 38.41 57.05 1.75 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.62 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.677 ' CB ' HD12 ' A' ' 7' ' ' LEU . 20.4 mtp85 56.63 39.2 29.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.023 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.537 ' O ' HG22 ' A' ' 4' ' ' ILE . 22.5 mm 50.65 38.61 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.019 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 45.2 p90 35.23 35.57 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.789 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.444 ' O ' ' N ' ' A' ' 8' ' ' PHE . 14.2 tt0 -173.25 -84.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.862 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.677 HD12 ' CB ' ' A' ' 3' ' ' ARG . 8.1 mt 55.99 -83.74 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.743 0.306 . . . . 0.0 111.124 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.444 ' N ' ' O ' ' A' ' 6' ' ' GLN . 8.6 m-85 -136.21 80.78 1.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.794 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.522 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -71.78 -43.69 11.39 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.259 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 9' ' ' ASP . 51.6 Cg_exo -54.46 -36.72 88.92 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.3 2.0 . . . . 0.0 112.385 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.91 -69.38 0.16 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.411 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.596 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.4 OUTLIER -55.58 -46.68 77.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.979 -179.655 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.11 70.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.08 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.1 mt -69.94 -44.8 68.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.767 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 12' ' ' GLN . 10.6 p -68.91 -27.08 34.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -73.48 -55.27 6.18 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.746 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -61.69 -47.88 83.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.062 0.458 . . . . 0.0 110.51 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.78 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -58.42 -37.51 75.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.369 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.709 ' O ' HG13 ' A' ' 23' ' ' VAL . 19.0 m -67.08 -55.3 14.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.028 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -59.63 -44.33 93.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.334 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.894 HD23 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.03 -57.77 6.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.894 ' N ' HD23 ' A' ' 21' ' ' LEU . 72.5 t80 -50.63 -49.12 57.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.77 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.709 HG13 ' O ' ' A' ' 19' ' ' THR . 19.4 m -64.16 -50.28 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.737 0.303 . . . . 0.0 111.525 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.9 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 10.5 tp -52.83 -65.28 0.59 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 111.072 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.63 -22.93 25.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.576 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.708 HD23 ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -66.34 -53.44 36.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 179.152 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.9 ' HG ' ' O ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -63.11 -46.9 85.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 110.551 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.695 HD13 HD12 ' A' ' 27' ' ' LEU . 39.3 mm -63.6 -61.33 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.968 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.439 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 25.1 t-80 -55.11 -43.18 73.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.218 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.869 ' HA ' HD22 ' A' ' 33' ' ' LEU . 57.0 t80 -61.52 -31.56 71.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.057 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.657 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.4 tt -72.87 -47.23 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.827 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.657 HD23 ' CG2' ' A' ' 31' ' ' ILE . 4.1 mt -64.75 -54.24 34.57 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.15 0.5 . . . . 0.0 110.017 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.875 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -56.35 -39.02 72.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.957 179.449 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.875 ' N ' HD23 ' A' ' 33' ' ' LEU . 3.6 m -60.72 -51.04 71.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.0 m -62.82 -38.1 89.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.747 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -63.83 -45.7 88.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.706 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -36.82 85.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.452 . . . . 0.0 110.39 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.411 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.6 m-85 -61.4 -64.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.626 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 11.4 m-20 -60.77 -18.1 52.99 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.234 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.402 ' HA ' ' HB2' ' A' ' 44' ' ' ALA . 16.4 t-105 -69.75 -73.68 0.15 Allowed 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.757 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.76 -16.71 58.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.195 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.626 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 6.7 mm-40 -64.78 -69.03 0.31 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.675 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -168.1 33.83 0.2 Allowed Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.518 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.415 ' O ' ' CB ' ' A' ' 45' ' ' SER . . . -66.43 113.65 4.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.696 0.284 . . . . 0.0 111.155 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.415 ' CB ' ' O ' ' A' ' 44' ' ' ALA . 0.3 OUTLIER 80.51 26.48 0.29 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.996 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.4 p -149.06 -46.83 0.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.852 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.4 ' CE ' ' HD2' ' A' ' 48' ' ' PRO . 0.3 OUTLIER 63.34 130.12 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.49 ' O ' HG12 ' A' ' 49' ' ' VAL . 51.1 Cg_exo -53.09 109.14 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.433 2.089 . . . . 0.0 112.313 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.651 HG13 ' HG2' ' A' ' 50' ' ' GLN . 0.3 OUTLIER 55.77 -175.14 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.337 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.651 ' HG2' HG13 ' A' ' 49' ' ' VAL . 5.3 mt-30 78.06 74.2 0.06 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.845 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.0 t -79.96 139.5 37.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.944 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 71.6 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.907 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 mmt . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.753 0.311 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 9.8 m-90 39.14 67.06 0.47 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.714 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.476 ' CB ' ' HA ' ' A' ' 7' ' ' LEU . 1.9 mmt85 54.41 26.89 7.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.211 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.594 ' O ' HG22 ' A' ' 4' ' ' ILE . 19.8 mm 59.05 18.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.081 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.472 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 3.0 t-105 86.18 -23.98 0.14 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.728 0.299 . . . . 0.0 111.048 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.444 ' HB3' ' CB ' ' A' ' 9' ' ' ASP . 0.3 OUTLIER -67.4 -31.55 71.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.932 0.396 . . . . 0.0 110.252 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.476 ' HA ' ' CB ' ' A' ' 3' ' ' ARG . 0.3 OUTLIER 59.12 81.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.759 179.323 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.437 ' CZ ' ' NH1' ' A' ' 3' ' ' ARG . 87.3 m-85 54.43 21.35 3.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.997 178.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.444 ' CB ' ' HB3' ' A' ' 6' ' ' GLN . 0.5 OUTLIER -73.15 -51.65 5.87 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.665 0.269 . . . . 0.0 110.91 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 9' ' ' ASP . 53.1 Cg_exo -55.17 -29.31 65.67 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.534 2.156 . . . . 0.0 112.295 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.839 ' O ' HG23 ' A' ' 15' ' ' VAL . 51.1 ttt-85 -63.78 -72.58 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.974 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -58.94 -35.97 73.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.98 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.493 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.19 -46.08 85.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.113 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.13 -34.23 77.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.404 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.839 HG23 ' O ' ' A' ' 11' ' ' ARG . 35.3 t -68.21 -28.72 41.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.149 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.34 -43.41 31.48 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.617 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.538 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -63.3 -61.04 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.236 0.541 . . . . 0.0 110.424 179.416 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.86 -47.83 76.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.075 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.609 ' O ' HG13 ' A' ' 23' ' ' VAL . 89.7 m -66.0 -51.24 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.685 0.279 . . . . 0.0 111.29 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -59.61 -35.53 74.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.861 HD23 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.78 -61.26 1.96 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.678 179.655 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.861 ' N ' HD23 ' A' ' 21' ' ' LEU . 25.7 t80 -54.02 -44.22 70.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.986 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.609 HG13 ' O ' ' A' ' 19' ' ' THR . 29.2 m -65.2 -49.21 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.824 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.2 OUTLIER -60.49 -45.25 94.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.893 0.378 . . . . 0.0 110.719 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.824 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -59.99 -39.75 86.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.794 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.547 HD11 ' CE2' ' A' ' 22' ' ' PHE . 23.1 mt -64.38 -41.57 96.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.736 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 23' ' ' VAL . 6.3 mp -63.09 -57.46 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.077 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.696 HD12 ' N ' ' A' ' 29' ' ' HIS . 2.2 pp -60.75 -50.98 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.201 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.696 ' N ' HD12 ' A' ' 28' ' ' ILE . 32.4 t-80 -56.78 -38.1 72.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.909 0.385 . . . . 0.0 110.456 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.871 ' HA ' HD22 ' A' ' 33' ' ' LEU . 43.5 t80 -64.7 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.892 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.661 ' CG2' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -71.24 -45.59 69.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.82 0.343 . . . . 0.0 110.651 179.676 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.661 HD23 ' CG2' ' A' ' 31' ' ' ILE . 3.7 mt -65.67 -53.99 33.68 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.08 0.467 . . . . 0.0 110.091 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.912 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -57.81 -40.99 81.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.228 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.912 ' N ' HD23 ' A' ' 33' ' ' LEU . 65.2 p -62.66 -49.79 73.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.722 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.9 m -61.77 -41.07 97.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.112 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.71 -53.22 54.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.92 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -63.85 -35.03 79.29 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.597 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 51.2 t80 -60.02 -66.3 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.429 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.649 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 13.4 m-80 -59.67 -17.55 34.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.034 0.445 . . . . 0.0 111.033 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.401 ' CZ3' ' HA ' ' A' ' 45' ' ' SER . 0.6 OUTLIER -68.27 -75.98 0.1 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.819 179.505 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.409 ' C ' HD12 ' A' ' 41' ' ' LEU . 4.2 pp -62.92 -16.18 58.15 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.362 178.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.649 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 2.3 mm-40 -64.84 -55.95 16.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.806 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -167.33 -20.18 0.02 OUTLIER Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.532 -0.842 . . . . 0.0 113.42 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.63 -23.82 67.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.992 0.396 . . . . 0.0 111.313 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.401 ' HA ' ' CZ3' ' A' ' 40' ' ' TRP . 0.5 OUTLIER -72.17 -36.68 69.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.886 0.374 . . . . 0.0 110.709 179.788 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 11.7 p -88.29 -31.66 18.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.848 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 20.2 tttm 74.24 87.82 0.09 OUTLIER Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.853 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.431 ' O ' HG12 ' A' ' 49' ' ' VAL . 57.3 Cg_endo -70.92 -167.98 0.3 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.577 2.185 . . . . 0.0 112.296 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.523 HG13 ' N ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER 57.82 172.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.523 ' N ' HG13 ' A' ' 49' ' ' VAL . 0.0 OUTLIER -164.17 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.908 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.9 m -80.18 86.23 5.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.865 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.9 mtp . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.697 0.284 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 3.0 m0 40.37 33.26 0.16 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.718 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.715 ' HB3' HD11 ' A' ' 7' ' ' LEU . 28.2 mtt85 52.69 46.43 26.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.988 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.514 ' O ' HG22 ' A' ' 4' ' ' ILE . 14.7 mm 45.65 28.53 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.283 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.501 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 3.1 t90 90.41 -42.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.816 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.681 ' O ' HD12 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -176.21 -35.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.236 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.715 HD11 ' HB3' ' A' ' 3' ' ' ARG . 0.5 OUTLIER 69.41 -67.62 0.22 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.826 -179.542 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.502 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 3.6 m-85 -103.71 -60.0 1.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.895 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.666 ' HB3' ' HD3' ' A' ' 10' ' ' PRO . 5.9 t0 100.67 -60.6 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.68 0 C-N-CA 123.828 0.851 . . . . 0.0 111.981 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.666 ' HD3' ' HB3' ' A' ' 9' ' ' ASP . 52.2 Cg_exo -54.89 -34.41 85.68 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 121.747 1.631 . . . . 0.0 112.137 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.882 ' O ' HG23 ' A' ' 15' ' ' VAL . 1.1 tpm_? -69.63 -47.87 61.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.94 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -52.98 63.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.996 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.17 -33.14 74.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.042 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -69.74 -39.76 76.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 11' ' ' ARG . 40.7 t -69.62 -28.35 37.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.674 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.05 -56.41 5.3 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.619 -0.801 . . . . 0.0 111.598 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.727 HD12 ' N ' ' A' ' 18' ' ' ALA . 2.6 pp -62.57 -48.68 78.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.724 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.727 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -57.27 -47.47 81.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.26 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.779 ' O ' HG13 ' A' ' 23' ' ' VAL . 66.6 m -66.15 -34.71 78.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.623 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.43 ' O ' HG22 ' A' ' 23' ' ' VAL . 1.5 t80 -60.95 -55.68 30.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.111 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.6 pp -66.96 -42.78 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 0.0 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -56.46 -51.21 69.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.415 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.779 HG13 ' O ' ' A' ' 19' ' ' THR . 17.3 m -64.92 -50.16 76.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.479 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.545 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -55.6 -60.57 3.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.074 0.464 . . . . 0.0 110.952 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.476 ' HA ' HD11 ' A' ' 28' ' ' ILE . . . -58.39 -32.65 68.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.992 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.4 mt -65.1 -46.69 80.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.913 0.387 . . . . 0.0 110.627 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 23' ' ' VAL . 8.4 mp -62.2 -55.46 28.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.157 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 25' ' ' ALA . 16.6 pt -62.01 -45.89 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-O 120.8 0.333 . . . . 0.0 111.211 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.451 ' HA ' HD21 ' A' ' 32' ' ' LEU . 54.2 t60 -61.97 -36.71 82.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.649 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.28 -42.37 88.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.294 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.512 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -66.69 -50.06 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.319 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.642 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.4 pp -62.46 -26.67 68.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.642 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -61.3 -65.61 0.67 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.436 178.168 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.41 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 11.7 m -59.37 -19.08 44.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.194 178.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.8 m -72.66 -63.14 1.22 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.98 0.419 . . . . 0.0 110.786 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.79 -39.06 87.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -36.47 84.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.05 0.452 . . . . 0.0 109.984 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.41 ' CD1' ' O ' ' A' ' 34' ' ' SER . 1.4 m-85 -62.25 -63.26 1.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.261 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.621 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 0.7 OUTLIER -61.15 -18.77 59.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.207 179.657 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 11.9 t-105 -69.98 -72.7 0.18 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.83 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.5 tt -62.43 -17.26 58.88 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.164 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.621 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 10.9 mt-10 -64.21 -66.26 0.57 Allowed 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.537 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.441 ' O ' ' HD2' ' A' ' 48' ' ' PRO . . . -167.72 88.53 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.659 -0.782 . . . . 0.0 112.388 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.414 ' O ' ' CB ' ' A' ' 45' ' ' SER . . . -66.61 79.02 0.11 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.805 0.336 . . . . 0.0 110.902 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.414 ' CB ' ' O ' ' A' ' 44' ' ' ALA . 4.3 t 81.24 35.2 0.1 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.679 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.3 p -146.53 8.65 1.03 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.851 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HB3' ' CD ' ' A' ' 48' ' ' PRO . 10.5 ttpt -161.71 -65.96 0.02 OUTLIER Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 121.088 -0.245 . . . . 0.0 111.168 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.468 ' CD ' ' HB3' ' A' ' 47' ' ' LYS . 12.5 Cg_endo -55.61 -70.96 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.513 2.142 . . . . 0.0 112.241 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.44 HG12 ' N ' ' A' ' 50' ' ' GLN . 4.1 t -95.5 161.61 2.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.887 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.44 ' N ' HG12 ' A' ' 49' ' ' VAL . 20.9 mm-40 46.18 -167.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.162 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.6 33.67 15.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.001 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.913 -179.951 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.721 0.296 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 60.5 m95 39.12 33.99 0.1 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.626 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.5 mtt85 51.64 48.23 23.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.086 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.577 ' O ' HG22 ' A' ' 4' ' ' ILE . 23.3 mm 46.63 29.61 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.241 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.51 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 0.9 OUTLIER 92.19 -43.82 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.924 -179.698 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 8' ' ' PHE . 5.7 pt20 -174.35 30.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.348 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.8 mt 59.46 -82.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.973 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.426 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 18.2 m-85 -139.81 34.81 1.98 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.629 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.426 ' CB ' ' O ' ' A' ' 8' ' ' PHE . 0.9 OUTLIER 81.76 129.16 0.03 OUTLIER Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.677 -179.805 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.424 ' O ' HD12 ' A' ' 14' ' ' LEU . 34.4 Cg_exo -59.66 -35.06 96.07 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.331 2.021 . . . . 0.0 112.365 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.617 ' O ' HG22 ' A' ' 15' ' ' VAL . 0.1 OUTLIER -72.58 -61.49 1.78 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.281 -179.712 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -58.75 -42.03 87.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.954 0.407 . . . . 0.0 111.272 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.3 -43.53 90.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.527 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.424 HD12 ' O ' ' A' ' 10' ' ' PRO . 35.2 mt -67.5 -46.08 73.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.024 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.617 HG22 ' O ' ' A' ' 11' ' ' ARG . 35.5 m -70.0 -24.26 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.245 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.52 -56.6 4.98 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.998 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.91 -54.78 29.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.744 0.783 . . . . 0.0 109.856 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.83 -53.81 43.26 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.389 -1.278 . . . . 0.0 112.068 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.729 ' O ' HG13 ' A' ' 23' ' ' VAL . 47.9 m -66.56 -38.25 86.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.605 0.241 . . . . 0.0 111.311 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -59.86 -54.82 41.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.853 0.359 . . . . 0.0 111.261 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.756 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.6 pp -65.72 -48.0 73.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.979 0.419 . . . . 0.0 110.751 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.756 ' N ' HD12 ' A' ' 21' ' ' LEU . 4.2 m-85 -53.53 -55.83 22.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.478 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.729 HG13 ' O ' ' A' ' 19' ' ' THR . 17.9 m -60.28 -48.04 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.821 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.534 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -52.03 -67.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.949 0.404 . . . . 0.0 110.845 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.07 -24.75 64.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.995 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 HD22 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -65.22 -54.21 32.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.45 179.702 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.823 HD22 HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -62.88 -44.61 95.64 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.948 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.601 HG22 HD23 ' A' ' 32' ' ' LEU . 38.2 mm -62.9 -57.06 13.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.198 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.771 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 m-70 -61.41 -39.59 91.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.322 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.576 ' O ' HD23 ' A' ' 33' ' ' LEU . 68.8 t80 -60.78 -51.41 69.47 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.725 HD12 ' N ' ' A' ' 32' ' ' LEU . 2.2 pp -67.8 -50.61 58.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.798 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.5 pp -60.32 -51.32 70.04 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.672 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.798 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -62.73 -51.23 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.758 0.314 . . . . 0.0 110.355 179.349 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.72 ' H ' HD23 ' A' ' 33' ' ' LEU . 68.6 m -61.91 -70.8 0.17 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.3 m -43.03 -42.2 3.76 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.801 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -63.03 -47.94 80.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.993 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -35.48 81.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.65 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 4.7 m-85 -62.0 -66.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.636 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.53 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 44.1 m-20 -58.96 -20.19 50.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.127 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 27.6 t90 -67.99 -70.96 0.23 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.6 -16.11 59.98 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.007 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 1.6 tp10 -62.97 -70.94 0.18 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.5 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.627 ' O ' ' HB3' ' A' ' 44' ' ' ALA . . . -73.01 -97.38 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.575 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 43' ' ' GLY . . . 86.37 -73.42 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.105 0 C-N-CA 122.584 0.353 . . . . 0.0 111.097 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 97.8 p -72.71 -41.42 65.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.735 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.439 ' O ' ' CG ' ' A' ' 47' ' ' LYS . 6.7 p -88.51 -41.04 12.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.827 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.439 ' CG ' ' O ' ' A' ' 46' ' ' THR . 0.1 OUTLIER 52.1 168.19 0.04 OUTLIER Pre-proline 0 CA--C 1.532 0.25 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.488 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.1 -176.89 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.554 2.17 . . . . 0.0 112.322 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.657 ' O ' HG12 ' A' ' 49' ' ' VAL . 38.2 t 57.0 27.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.104 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 43.89 78.44 0.05 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.532 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.78 30.15 13.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.149 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.274 -0.869 . . . . 0.0 110.968 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 mmt . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.698 0.285 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 46.0 m95 38.62 71.48 0.16 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.687 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.675 ' C ' HD12 ' A' ' 4' ' ' ILE . 3.3 mmt-85 57.95 21.86 8.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.16 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.675 HD12 ' C ' ' A' ' 3' ' ' ARG . 3.6 mp 61.1 11.22 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.782 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.464 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 0.6 OUTLIER 87.03 -12.0 0.55 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 179.563 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.725 ' O ' HD12 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -174.02 -26.64 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.562 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.725 HD12 ' O ' ' A' ' 6' ' ' GLN . 0.1 OUTLIER 70.96 8.05 6.4 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.876 0.37 . . . . 0.0 110.844 -179.127 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 63.46 30.71 15.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.65 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.441 ' HA ' ' HD2' ' A' ' 10' ' ' PRO . 46.5 m-20 37.22 94.07 0.05 OUTLIER Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.882 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.441 ' HD2' ' HA ' ' A' ' 9' ' ' ASP . 9.8 Cg_endo -53.16 -54.0 5.77 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.499 2.132 . . . . 0.0 112.091 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.796 ' O ' HG23 ' A' ' 15' ' ' VAL . 5.0 ttt85 -57.76 -41.76 82.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.52 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.43 ' HB3' ' CB ' ' A' ' 9' ' ' ASP . 3.6 tp-100 -60.47 -41.72 94.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.866 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.6 85.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.746 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.443 ' C ' HD12 ' A' ' 14' ' ' LEU . 1.0 OUTLIER -69.29 -39.69 78.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.919 -179.514 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.796 HG23 ' O ' ' A' ' 11' ' ' ARG . 47.1 t -70.96 -27.4 29.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.713 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.42 -54.18 6.29 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.768 -0.73 . . . . 0.0 111.845 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 18' ' ' ALA . 2.7 pp -61.95 -49.98 73.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.933 0.397 . . . . 0.0 110.69 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.783 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -57.32 -50.34 73.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.018 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.782 ' O ' HG13 ' A' ' 23' ' ' VAL . 87.2 m -67.48 -30.83 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.602 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -60.48 -61.03 2.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.377 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -65.38 -41.75 93.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.939 0.4 . . . . 0.0 110.773 -179.84 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.414 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 2.4 m-85 -55.62 -53.46 56.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.493 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.782 HG13 ' O ' ' A' ' 19' ' ' THR . 13.4 m -65.77 -49.6 76.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.677 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.546 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -55.05 -58.78 6.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.641 -179.8 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.89 -47.89 83.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.345 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.554 HD12 ' C ' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -62.83 -42.62 99.8 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.428 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 23' ' ' VAL . 1.9 mm? -60.37 -55.6 31.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.808 0.337 . . . . 0.0 111.086 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.454 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 42.6 mt -61.81 -54.93 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.982 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.499 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 57.3 m80 -54.95 -38.82 68.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.666 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.87 ' HA ' HD22 ' A' ' 33' ' ' LEU . 20.2 t80 -64.67 -33.09 75.12 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.664 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.7 tt -71.65 -46.25 63.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.796 0.332 . . . . 0.0 110.626 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.664 HD23 ' CG2' ' A' ' 31' ' ' ILE . 4.0 mt -65.34 -54.51 27.94 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-O 121.157 0.503 . . . . 0.0 110.072 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.902 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -56.85 -40.15 75.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.12 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.902 ' N ' HD23 ' A' ' 33' ' ' LEU . 19.9 t -62.24 -49.79 74.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.717 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.1 m -60.19 -46.12 90.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.091 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 5.4 tt0 -63.2 -43.66 97.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.87 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.03 -40.26 94.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.664 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.49 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.9 m-85 -61.0 -65.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.597 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.528 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-20 -59.37 -19.42 46.69 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.979 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.415 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 1.3 m0 -67.55 -71.41 0.21 Allowed 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -63.61 -15.8 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.092 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 18.5 tt0 -62.94 -68.94 0.3 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.639 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.626 ' O ' ' HB3' ' A' ' 44' ' ' ALA . . . -167.92 -59.6 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.374 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' A' ' 43' ' ' GLY . . . 87.3 17.16 0.08 Allowed 'General case' 0 C--O 1.231 0.131 0 C-N-CA 122.647 0.379 . . . . 0.0 111.686 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.88 32.76 3.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.877 0.37 . . . . 0.0 110.521 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 p -149.52 -34.99 0.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.378 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -75.74 -61.37 0.91 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.031 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.413 ' HD3' ' CA ' ' A' ' 43' ' ' GLY . 54.9 Cg_endo -70.0 105.89 1.61 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.467 2.111 . . . . 0.0 112.296 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.612 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.7 p -145.23 37.72 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.047 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 44.81 79.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.405 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.422 HG22 ' N ' ' A' ' 52' ' ' SER . 4.0 m -158.45 -75.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.529 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.422 ' N ' HG22 ' A' ' 51' ' ' THR . 27.5 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.911 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.6 mmt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.632 0.253 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 29.6 m95 38.63 70.74 0.19 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.599 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 48.84 32.66 3.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.476 ' O ' HG22 ' A' ' 4' ' ' ILE . 30.6 mm 50.88 54.08 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 6.5 m95 33.42 38.89 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.71 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 34.76 36.43 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.886 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 77.3 mt -85.06 -34.46 22.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.799 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -138.34 39.11 2.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 5.7 m-20 -71.98 161.53 78.32 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.737 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.474 ' O ' HD12 ' A' ' 14' ' ' LEU . 33.6 Cg_endo -64.63 -51.13 1.99 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.565 2.176 . . . . 0.0 112.424 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.882 ' O ' HG23 ' A' ' 15' ' ' VAL . 7.2 mmt180 -72.56 -48.93 36.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.129 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 -58.49 -52.77 64.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.136 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.513 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -62.78 -36.57 83.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.474 HD12 ' O ' ' A' ' 10' ' ' PRO . 12.9 mt -66.63 -40.79 88.92 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.33 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 11' ' ' ARG . 43.8 t -68.08 -23.75 29.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.165 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CD1' ' A' ' 20' ' ' PHE . . . -74.28 -48.37 14.84 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.372 179.136 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -61.93 -57.03 13.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.353 0.596 . . . . 0.0 110.09 179.28 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.476 ' O ' HD13 ' A' ' 21' ' ' LEU . . . -53.24 -50.62 64.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.37 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.806 ' O ' HG13 ' A' ' 23' ' ' VAL . 81.2 m -66.82 -32.02 73.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.01 0.433 . . . . 0.0 110.683 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 16' ' ' GLY . 1.4 m-85 -60.06 -69.69 0.2 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.384 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.87 HD13 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -63.05 -32.41 73.78 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.822 -179.553 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.87 ' N ' HD13 ' A' ' 21' ' ' LEU . 37.9 t80 -59.26 -58.09 10.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.927 0.394 . . . . 0.0 110.614 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.838 ' HA ' HD23 ' A' ' 26' ' ' LEU . 5.0 m -65.67 -52.15 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.388 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.669 HD13 HD13 ' A' ' 28' ' ' ILE . 0.7 OUTLIER -51.91 -56.85 11.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.161 0.505 . . . . 0.0 111.159 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.71 71.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.897 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.838 HD23 ' HA ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER -64.76 -51.85 60.1 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.354 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.892 HD12 ' CD1' ' A' ' 28' ' ' ILE . 0.0 OUTLIER -66.28 -49.01 68.57 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 111.068 179.853 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.892 ' CD1' HD12 ' A' ' 27' ' ' LEU . 1.6 mp -60.66 -58.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.712 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.612 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 20.7 t-80 -54.46 -34.09 60.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.851 0.358 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.853 ' HA ' HD22 ' A' ' 33' ' ' LEU . 82.2 t80 -63.9 -38.47 91.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.813 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.68 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.4 tp -72.23 -46.59 57.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.67 0.272 . . . . 0.0 111.253 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.68 HD23 ' CG2' ' A' ' 31' ' ' ILE . 2.8 mt -64.5 -54.08 38.01 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.95 0.405 . . . . 0.0 110.421 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.853 HD22 ' HA ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -57.42 -40.03 77.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.165 179.701 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.847 ' N ' HD23 ' A' ' 33' ' ' LEU . 26.4 t -61.61 -56.7 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.148 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.7 m -60.58 -48.88 79.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 7.2 tt0 -62.46 -36.68 83.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.049 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -64.36 -45.26 88.54 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.956 0.408 . . . . 0.0 110.472 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.491 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.1 t80 -61.08 -60.99 2.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.179 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.539 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 85.5 m-20 -60.79 -18.93 58.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.025 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.413 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 0.8 OUTLIER -68.53 -70.15 0.28 Allowed 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.377 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 59.5 tp -63.5 -16.01 59.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.539 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 28.1 tt0 -63.77 -70.55 0.21 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.647 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 47' ' ' LYS . . . -74.02 -3.91 65.96 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.994 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.89 -30.87 71.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.054 0.427 . . . . 0.0 110.985 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.0 m -75.53 0.58 16.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.096 -179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.2 p -146.8 -51.13 0.21 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.668 0.27 . . . . 0.0 111.404 -179.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.491 ' N ' ' O ' ' A' ' 43' ' ' GLY . 4.6 mttt 64.14 164.1 0.12 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.971 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -61.98 -57.8 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.557 2.171 . . . . 0.0 112.456 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.5 t -145.68 -54.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.249 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 77.02 134.31 0.06 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.841 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.1 m -80.42 82.17 6.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.881 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.901 179.984 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.845 0.355 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.496 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.23 -46.52 83.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.017 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.696 ' HA ' HD12 ' A' ' 17' ' ' LEU . 8.6 mt -66.86 -35.69 80.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.271 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.3 t -70.54 -27.36 30.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.535 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.68 -49.13 11.29 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.098 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -63.61 -57.77 9.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.566 0.698 . . . . 0.0 109.862 179.392 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.51 -48.67 68.79 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.745 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.744 ' O ' HG13 ' A' ' 23' ' ' VAL . 93.2 m -68.29 -37.55 80.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.404 ' O ' HG22 ' A' ' 23' ' ' VAL . 38.7 t80 -60.11 -52.68 64.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.355 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.758 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.5 pp -66.51 -49.15 67.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.909 0.385 . . . . 0.0 110.804 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.758 ' N ' HD12 ' A' ' 21' ' ' LEU . 7.7 t80 -54.18 -49.23 69.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.767 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.849 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 22.1 m -65.76 -48.56 81.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.618 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.888 ' CD1' HD11 ' A' ' 28' ' ' ILE . 0.3 OUTLIER -52.35 -65.04 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.98 0.419 . . . . 0.0 111.373 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.882 ' HA ' HD12 ' A' ' 28' ' ' ILE . . . -57.64 -31.74 66.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.182 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.596 HD11 ' CE2' ' A' ' 22' ' ' PHE . 11.3 mt -63.99 -49.44 72.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.644 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.849 ' HG ' ' O ' ' A' ' 23' ' ' VAL . 3.6 mt -62.83 -37.89 88.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.914 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.888 HD11 ' CD1' ' A' ' 24' ' ' LEU . 14.6 mt -63.12 -62.88 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.124 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.555 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 3.2 m170 -59.94 -38.6 82.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.032 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.458 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 25.6 t80 -64.66 -45.25 87.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.732 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.472 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.8 OUTLIER -68.71 -47.61 75.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.407 -179.591 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.776 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.3 pp -65.97 -47.71 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.936 0.398 . . . . 0.0 110.305 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.776 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -61.9 -45.47 93.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.401 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.456 ' N ' HD12 ' A' ' 33' ' ' LEU . 30.6 t -62.09 -55.27 30.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.414 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.1 m -62.43 -39.58 93.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -64.61 -57.69 8.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.24 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -37.41 87.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.143 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.502 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 85.9 t80 -61.49 -66.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.0 t-20 -57.84 -20.44 36.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.233 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -68.68 -70.68 0.25 Allowed 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -63.44 -17.34 62.59 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.591 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 46.0 tp10 . . . . . 0 N--CA 1.45 -0.466 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.539 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.791 0.329 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -63.6 -49.15 74.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.941 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.06 -36.15 82.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.285 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 38.1 t -67.83 -27.61 38.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.081 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.12 -42.53 35.94 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.829 -0.7 . . . . 0.0 111.55 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.526 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -63.7 -61.49 2.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.24 0.543 . . . . 0.0 110.368 179.25 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HA ' HD21 ' A' ' 21' ' ' LEU . . . -54.88 -45.56 74.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.897 -179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.734 ' O ' HG13 ' A' ' 23' ' ' VAL . 96.4 m -68.09 -42.68 79.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.718 0.294 . . . . 0.0 111.212 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -60.75 -49.37 77.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.48 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.2 pp -65.71 -50.66 64.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.858 0.361 . . . . 0.0 110.848 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.783 ' N ' HD12 ' A' ' 21' ' ' LEU . 2.0 t80 -55.48 -49.98 71.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.66 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.734 HG13 ' O ' ' A' ' 19' ' ' THR . 22.3 m -63.4 -50.61 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.68 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -59.46 -34.74 72.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.983 0.421 . . . . 0.0 110.18 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.68 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -62.06 -53.57 53.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.954 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 23' ' ' VAL . 1.3 pp -62.94 -33.62 75.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.82 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 23' ' ' VAL . 2.0 mm? -62.66 -48.41 79.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.831 0.348 . . . . 0.0 110.701 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.615 HG22 HD23 ' A' ' 32' ' ' LEU . 9.2 mt -63.45 -54.32 34.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.159 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.545 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 t60 -58.98 -40.05 83.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.994 0.426 . . . . 0.0 110.81 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.494 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 24.0 t80 -65.09 -44.48 88.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.5 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.475 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 2.5 tp -68.59 -47.88 74.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.081 -0.247 . . . . 0.0 111.294 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.3 pp -65.49 -48.72 71.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.851 0.358 . . . . 0.0 110.173 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.783 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -61.31 -41.71 97.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.206 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -62.79 -59.53 4.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.15 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.0 m -59.51 -48.18 82.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.505 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 2.6 pp20? -62.13 -43.52 98.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -66.58 -36.84 83.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.047 0.451 . . . . 0.0 110.473 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.524 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 10.7 t80 -61.81 -65.74 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.711 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.521 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 58.4 m-80 -57.63 -22.05 43.21 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.986 0.422 . . . . 0.0 111.13 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -67.44 -70.57 0.25 Allowed 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.519 ' C ' HD12 ' A' ' 41' ' ' LEU . 4.5 pp -64.41 -14.84 58.87 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.031 177.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.524 ' HB2' ' O ' ' A' ' 38' ' ' PHE . 2.2 tt0 . . . . . 0 N--CA 1.45 -0.464 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.508 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.712 ' NE2' ' HB2' ' A' ' 13' ' ' ALA . 4.1 pp0? . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.933 0.396 . . . . 0.0 111.465 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.712 ' HB2' ' NE2' ' A' ' 12' ' ' GLN . . . -60.87 -36.14 78.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.769 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.434 ' HG ' ' N ' ' A' ' 15' ' ' VAL . 0.6 OUTLIER -72.23 -41.34 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.619 0.247 . . . . 0.0 111.056 -179.654 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 12' ' ' GLN . 7.2 p -70.25 -26.57 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.592 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.76 -54.82 5.7 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.881 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.779 HD12 ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -63.12 -49.19 75.39 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.979 0.419 . . . . 0.0 110.91 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.779 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -59.59 -47.34 85.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.746 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.715 ' O ' HG13 ' A' ' 23' ' ' VAL . 81.7 m -66.6 -50.6 62.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.39 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -59.92 -44.51 94.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.738 0.304 . . . . 0.0 111.283 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.796 HD13 ' N ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -67.17 -54.81 17.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.967 0.413 . . . . 0.0 110.704 179.919 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.796 ' N ' HD13 ' A' ' 21' ' ' LEU . 65.9 t80 -53.82 -48.21 70.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.799 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.715 HG13 ' O ' ' A' ' 19' ' ' THR . 22.7 m -64.12 -49.31 81.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 111.661 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.552 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -58.27 -57.92 10.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.012 0.434 . . . . 0.0 111.265 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.5 73.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.815 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.547 ' C ' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -61.81 -37.35 84.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 0.0 110.891 -179.605 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 23' ' ' VAL . 1.9 mp -60.05 -56.52 20.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.604 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.0 mm -63.4 -28.7 45.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.809 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.533 ' O ' HD12 ' A' ' 33' ' ' LEU . 1.9 t-80 -62.79 -65.09 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.245 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 27' ' ' LEU . 2.3 p90 -62.43 -31.61 72.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.561 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.511 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.5 tp -69.59 -51.69 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.911 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.518 ' C ' HD12 ' A' ' 32' ' ' LEU . 2.0 pp -64.29 -41.39 96.9 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 29' ' ' HIS . 11.9 mt -60.32 -59.06 6.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.589 178.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.403 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 2.4 t -59.98 -28.11 67.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.189 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 m -66.09 -52.69 46.41 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.977 0.418 . . . . 0.0 110.536 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 40' ' ' TRP . 6.2 tt0 -62.41 -45.14 94.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.624 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.468 ' O ' HD12 ' A' ' 41' ' ' LEU . 7.9 mmt-85 -64.74 -36.23 83.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.504 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.548 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.9 m-85 -61.21 -66.35 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.386 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 11.9 m-80 -59.81 -18.77 46.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.845 0.355 . . . . 0.0 111.16 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.404 ' HB2' ' O ' ' A' ' 36' ' ' GLU . 72.8 t-105 -68.11 -74.91 0.11 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.793 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.895 HD13 ' N ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -63.19 -15.21 56.2 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.183 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.895 ' N ' HD13 ' A' ' 41' ' ' LEU . 4.7 tt0 . . . . . 0 N--CA 1.451 -0.409 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.291 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.84 0.352 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.483 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.11 -40.25 94.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.33 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 17' ' ' LEU . 12.3 mt -66.02 -43.6 87.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.608 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m -69.28 -22.01 25.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.624 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.41 -50.13 10.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.772 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -63.91 -55.73 20.49 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.643 0.735 . . . . 0.0 109.558 178.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.563 ' HA ' HD21 ' A' ' 21' ' ' LEU . . . -54.13 -38.28 65.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.528 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.754 ' O ' HG13 ' A' ' 23' ' ' VAL . 4.5 m -67.61 -42.87 81.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.828 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.431 ' O ' HG22 ' A' ' 23' ' ' VAL . 18.4 t80 -60.76 -51.84 67.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.089 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.745 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.6 pp -66.31 -47.73 72.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.611 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.745 ' N ' HD12 ' A' ' 21' ' ' LEU . 75.9 t80 -55.71 -48.61 74.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.766 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.754 HG13 ' O ' ' A' ' 19' ' ' THR . 25.3 m -65.24 -49.03 81.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.814 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.862 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -59.16 -44.81 92.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.913 0.387 . . . . 0.0 110.569 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.862 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -61.18 -56.82 16.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.238 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.84 -28.67 70.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.752 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.665 HD13 ' O ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -63.48 -60.43 3.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.736 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.513 HG22 HD23 ' A' ' 32' ' ' LEU . 5.1 mt -62.77 -44.98 99.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.621 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 39.8 m170 -60.23 -42.56 95.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.849 ' HA ' HD22 ' A' ' 33' ' ' LEU . 19.5 t80 -64.63 -38.38 90.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.591 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.469 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -70.38 -47.83 63.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.03 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.794 HD12 ' N ' ' A' ' 33' ' ' LEU . 3.3 pp -65.23 -51.51 60.49 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.892 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -59.4 -40.08 85.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.272 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.892 ' N ' HD23 ' A' ' 33' ' ' LEU . 27.4 t -61.51 -49.99 74.52 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.58 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.4 m -59.39 -44.17 92.84 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.63 -49.6 74.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -64.9 -32.31 73.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.486 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.516 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.7 m-85 -62.19 -63.97 1.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.442 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.528 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-80 -58.67 -21.68 54.91 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 110.983 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -70.49 0.25 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.12 -15.41 56.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 13.3 tp10 . . . . . 0 N--CA 1.451 -0.412 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.709 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.596 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.974 0.416 . . . . 0.0 110.979 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.11 70.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.08 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.1 mt -69.94 -44.8 68.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.767 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 12' ' ' GLN . 10.6 p -68.91 -27.08 34.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -73.48 -55.27 6.18 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.746 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -61.69 -47.88 83.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.062 0.458 . . . . 0.0 110.51 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.78 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -58.42 -37.51 75.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.369 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.709 ' O ' HG13 ' A' ' 23' ' ' VAL . 19.0 m -67.08 -55.3 14.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.028 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -59.63 -44.33 93.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.334 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.894 HD23 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.03 -57.77 6.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.894 ' N ' HD23 ' A' ' 21' ' ' LEU . 72.5 t80 -50.63 -49.12 57.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.77 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.709 HG13 ' O ' ' A' ' 19' ' ' THR . 19.4 m -64.16 -50.28 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.737 0.303 . . . . 0.0 111.525 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.9 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 10.5 tp -52.83 -65.28 0.59 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 111.072 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.63 -22.93 25.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.576 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.708 HD23 ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -66.34 -53.44 36.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 179.152 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.9 ' HG ' ' O ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -63.11 -46.9 85.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 110.551 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.695 HD13 HD12 ' A' ' 27' ' ' LEU . 39.3 mm -63.6 -61.33 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.968 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.439 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 25.1 t-80 -55.11 -43.18 73.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.218 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.869 ' HA ' HD22 ' A' ' 33' ' ' LEU . 57.0 t80 -61.52 -31.56 71.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.057 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.657 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.4 tt -72.87 -47.23 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.827 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.657 HD23 ' CG2' ' A' ' 31' ' ' ILE . 4.1 mt -64.75 -54.24 34.57 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.15 0.5 . . . . 0.0 110.017 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.875 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -56.35 -39.02 72.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.957 179.449 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.875 ' N ' HD23 ' A' ' 33' ' ' LEU . 3.6 m -60.72 -51.04 71.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.0 m -62.82 -38.1 89.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.747 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -63.83 -45.7 88.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.706 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -36.82 85.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.452 . . . . 0.0 110.39 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.411 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.6 m-85 -61.4 -64.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.626 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 11.4 m-20 -60.77 -18.1 52.99 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.234 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -69.75 -73.68 0.15 Allowed 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.757 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.76 -16.71 58.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.195 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.626 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 6.7 mm-40 . . . . . 0 N--CA 1.45 -0.474 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.675 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.792 0.33 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.493 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.19 -46.08 85.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.113 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.13 -34.23 77.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.404 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.3 t -68.21 -28.72 41.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.149 179.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.34 -43.41 31.48 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.617 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.538 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -63.3 -61.04 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.236 0.541 . . . . 0.0 110.424 179.416 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.86 -47.83 76.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.075 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.609 ' O ' HG13 ' A' ' 23' ' ' VAL . 89.7 m -66.0 -51.24 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.685 0.279 . . . . 0.0 111.29 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -59.61 -35.53 74.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.861 HD23 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.78 -61.26 1.96 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.678 179.655 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.861 ' N ' HD23 ' A' ' 21' ' ' LEU . 25.7 t80 -54.02 -44.22 70.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.986 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.609 HG13 ' O ' ' A' ' 19' ' ' THR . 29.2 m -65.2 -49.21 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.824 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.2 OUTLIER -60.49 -45.25 94.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.893 0.378 . . . . 0.0 110.719 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.824 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -59.99 -39.75 86.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.794 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.547 HD11 ' CE2' ' A' ' 22' ' ' PHE . 23.1 mt -64.38 -41.57 96.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.736 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 23' ' ' VAL . 6.3 mp -63.09 -57.46 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.077 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.696 HD12 ' N ' ' A' ' 29' ' ' HIS . 2.2 pp -60.75 -50.98 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.201 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.696 ' N ' HD12 ' A' ' 28' ' ' ILE . 32.4 t-80 -56.78 -38.1 72.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.909 0.385 . . . . 0.0 110.456 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.871 ' HA ' HD22 ' A' ' 33' ' ' LEU . 43.5 t80 -64.7 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.892 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.661 ' CG2' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -71.24 -45.59 69.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.82 0.343 . . . . 0.0 110.651 179.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.661 HD23 ' CG2' ' A' ' 31' ' ' ILE . 3.7 mt -65.67 -53.99 33.68 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.08 0.467 . . . . 0.0 110.091 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.912 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -57.81 -40.99 81.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.228 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.912 ' N ' HD23 ' A' ' 33' ' ' LEU . 65.2 p -62.66 -49.79 73.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.722 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.9 m -61.77 -41.07 97.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.112 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.71 -53.22 54.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.92 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -63.85 -35.03 79.29 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.597 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 51.2 t80 -60.02 -66.3 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.429 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.649 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 13.4 m-80 -59.67 -17.55 34.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.034 0.445 . . . . 0.0 111.033 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -68.27 -75.98 0.1 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.819 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.409 ' C ' HD12 ' A' ' 41' ' ' LEU . 4.2 pp -62.92 -16.18 58.15 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.362 178.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.649 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 2.3 mm-40 . . . . . 0 N--CA 1.45 -0.472 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.806 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.851 0.358 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.17 -33.14 74.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.042 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -69.74 -39.76 76.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 40.7 t -69.62 -28.35 37.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.674 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.05 -56.41 5.3 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.619 -0.801 . . . . 0.0 111.598 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.727 HD12 ' N ' ' A' ' 18' ' ' ALA . 2.6 pp -62.57 -48.68 78.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.724 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.727 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -57.27 -47.47 81.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.26 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.779 ' O ' HG13 ' A' ' 23' ' ' VAL . 66.6 m -66.15 -34.71 78.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.623 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.43 ' O ' HG22 ' A' ' 23' ' ' VAL . 1.5 t80 -60.95 -55.68 30.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.111 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.6 pp -66.96 -42.78 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 0.0 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -56.46 -51.21 69.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.415 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.779 HG13 ' O ' ' A' ' 19' ' ' THR . 17.3 m -64.92 -50.16 76.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.479 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.545 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -55.6 -60.57 3.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.074 0.464 . . . . 0.0 110.952 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.476 ' HA ' HD11 ' A' ' 28' ' ' ILE . . . -58.39 -32.65 68.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.992 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.4 mt -65.1 -46.69 80.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.913 0.387 . . . . 0.0 110.627 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 23' ' ' VAL . 8.4 mp -62.2 -55.46 28.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.157 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 25' ' ' ALA . 16.6 pt -62.01 -45.89 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-O 120.8 0.333 . . . . 0.0 111.211 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.451 ' HA ' HD21 ' A' ' 32' ' ' LEU . 54.2 t60 -61.97 -36.71 82.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.649 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.28 -42.37 88.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.294 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.512 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -66.69 -50.06 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.319 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.642 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.4 pp -62.46 -26.67 68.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.642 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -61.3 -65.61 0.67 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.436 178.168 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.41 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 11.7 m -59.37 -19.08 44.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.194 178.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.8 m -72.66 -63.14 1.22 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.98 0.419 . . . . 0.0 110.786 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.79 -39.06 87.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -36.47 84.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.05 0.452 . . . . 0.0 109.984 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.41 ' CD1' ' O ' ' A' ' 34' ' ' SER . 1.4 m-85 -62.25 -63.26 1.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.261 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.621 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 0.7 OUTLIER -61.15 -18.77 59.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.207 179.657 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 11.9 t-105 -69.98 -72.7 0.18 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.83 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.5 tt -62.43 -17.26 58.88 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.164 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.621 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 10.9 mt-10 . . . . . 0 N--CA 1.448 -0.53 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.537 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.954 0.407 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.3 -43.53 90.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.527 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.2 mt -67.5 -46.08 73.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.024 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.0 -24.26 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.245 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.52 -56.6 4.98 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.998 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.91 -54.78 29.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.744 0.783 . . . . 0.0 109.856 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.83 -53.81 43.26 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.389 -1.278 . . . . 0.0 112.068 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.729 ' O ' HG13 ' A' ' 23' ' ' VAL . 47.9 m -66.56 -38.25 86.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.605 0.241 . . . . 0.0 111.311 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -59.86 -54.82 41.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.853 0.359 . . . . 0.0 111.261 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.756 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.6 pp -65.72 -48.0 73.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.979 0.419 . . . . 0.0 110.751 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.756 ' N ' HD12 ' A' ' 21' ' ' LEU . 4.2 m-85 -53.53 -55.83 22.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.478 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.729 HG13 ' O ' ' A' ' 19' ' ' THR . 17.9 m -60.28 -48.04 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.821 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.534 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -52.03 -67.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.949 0.404 . . . . 0.0 110.845 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.07 -24.75 64.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.995 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 HD22 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -65.22 -54.21 32.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.45 179.702 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.823 HD22 HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -62.88 -44.61 95.64 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.948 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.601 HG22 HD23 ' A' ' 32' ' ' LEU . 38.2 mm -62.9 -57.06 13.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.198 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.771 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 m-70 -61.41 -39.59 91.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.322 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.576 ' O ' HD23 ' A' ' 33' ' ' LEU . 68.8 t80 -60.78 -51.41 69.47 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.725 HD12 ' N ' ' A' ' 32' ' ' LEU . 2.2 pp -67.8 -50.61 58.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.798 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.5 pp -60.32 -51.32 70.04 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.672 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.798 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -62.73 -51.23 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.758 0.314 . . . . 0.0 110.355 179.349 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.72 ' H ' HD23 ' A' ' 33' ' ' LEU . 68.6 m -61.91 -70.8 0.17 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.3 m -43.03 -42.2 3.76 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.801 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -63.03 -47.94 80.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.993 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -35.48 81.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.65 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 4.7 m-85 -62.0 -66.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.636 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.53 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 44.1 m-20 -58.96 -20.19 50.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.127 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 27.6 t90 -67.99 -70.96 0.23 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.6 -16.11 59.98 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.007 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 1.6 tp10 . . . . . 0 N--CA 1.449 -0.476 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.5 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.899 0.38 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.6 85.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.746 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.443 ' C ' HD12 ' A' ' 14' ' ' LEU . 1.0 OUTLIER -69.29 -39.69 78.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.919 -179.514 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.1 t -70.96 -27.4 29.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.713 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.42 -54.18 6.29 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.768 -0.73 . . . . 0.0 111.845 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 18' ' ' ALA . 2.7 pp -61.95 -49.98 73.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.933 0.397 . . . . 0.0 110.69 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.783 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -57.32 -50.34 73.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.018 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.782 ' O ' HG13 ' A' ' 23' ' ' VAL . 87.2 m -67.48 -30.83 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.602 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -60.48 -61.03 2.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.377 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -65.38 -41.75 93.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.939 0.4 . . . . 0.0 110.773 -179.84 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.414 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 2.4 m-85 -55.62 -53.46 56.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.493 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.782 HG13 ' O ' ' A' ' 19' ' ' THR . 13.4 m -65.77 -49.6 76.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.677 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.546 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -55.05 -58.78 6.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.641 -179.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.89 -47.89 83.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.345 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.554 ' C ' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -62.83 -42.62 99.8 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.428 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 23' ' ' VAL . 1.9 mm? -60.37 -55.6 31.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.808 0.337 . . . . 0.0 111.086 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.454 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 42.6 mt -61.81 -54.93 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.982 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.499 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 57.3 m80 -54.95 -38.82 68.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.666 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.87 ' HA ' HD22 ' A' ' 33' ' ' LEU . 20.2 t80 -64.67 -33.09 75.12 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.664 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.7 tt -71.65 -46.25 63.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.796 0.332 . . . . 0.0 110.626 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.664 HD23 ' CG2' ' A' ' 31' ' ' ILE . 4.0 mt -65.34 -54.51 27.94 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-O 121.157 0.503 . . . . 0.0 110.072 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.902 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -56.85 -40.15 75.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.12 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.902 ' N ' HD23 ' A' ' 33' ' ' LEU . 19.9 t -62.24 -49.79 74.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.717 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.1 m -60.19 -46.12 90.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.091 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 5.4 tt0 -63.2 -43.66 97.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.87 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.03 -40.26 94.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.664 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.49 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.9 m-85 -61.0 -65.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.597 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.528 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-20 -59.37 -19.42 46.69 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.979 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.415 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 1.3 m0 -67.55 -71.41 0.21 Allowed 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -63.61 -15.8 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.092 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 18.5 tt0 . . . . . 0 N--CA 1.449 -0.497 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.639 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.801 0.334 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.513 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -62.78 -36.57 83.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.9 mt -66.63 -40.79 88.92 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.33 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.8 t -68.08 -23.75 29.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.165 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CD1' ' A' ' 20' ' ' PHE . . . -74.28 -48.37 14.84 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.372 179.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -61.93 -57.03 13.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.353 0.596 . . . . 0.0 110.09 179.28 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.476 ' O ' HD13 ' A' ' 21' ' ' LEU . . . -53.24 -50.62 64.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.37 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.806 ' O ' HG13 ' A' ' 23' ' ' VAL . 81.2 m -66.82 -32.02 73.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.01 0.433 . . . . 0.0 110.683 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 16' ' ' GLY . 1.4 m-85 -60.06 -69.69 0.2 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.384 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.87 HD13 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -63.05 -32.41 73.78 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.822 -179.553 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.87 ' N ' HD13 ' A' ' 21' ' ' LEU . 37.9 t80 -59.26 -58.09 10.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.927 0.394 . . . . 0.0 110.614 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.838 ' HA ' HD23 ' A' ' 26' ' ' LEU . 5.0 m -65.67 -52.15 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.388 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.669 HD13 HD13 ' A' ' 28' ' ' ILE . 0.7 OUTLIER -51.91 -56.85 11.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.161 0.505 . . . . 0.0 111.159 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.71 71.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.897 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.838 HD23 ' HA ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER -64.76 -51.85 60.1 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.354 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.892 HD12 ' CD1' ' A' ' 28' ' ' ILE . 0.0 OUTLIER -66.28 -49.01 68.57 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 111.068 179.853 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.892 ' CD1' HD12 ' A' ' 27' ' ' LEU . 1.6 mp -60.66 -58.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.712 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.612 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 20.7 t-80 -54.46 -34.09 60.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.851 0.358 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.853 ' HA ' HD22 ' A' ' 33' ' ' LEU . 82.2 t80 -63.9 -38.47 91.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.813 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.68 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.4 tp -72.23 -46.59 57.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.67 0.272 . . . . 0.0 111.253 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.68 HD23 ' CG2' ' A' ' 31' ' ' ILE . 2.8 mt -64.5 -54.08 38.01 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.95 0.405 . . . . 0.0 110.421 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.853 HD22 ' HA ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -57.42 -40.03 77.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.165 179.701 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.847 ' N ' HD23 ' A' ' 33' ' ' LEU . 26.4 t -61.61 -56.7 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.148 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.7 m -60.58 -48.88 79.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 7.2 tt0 -62.46 -36.68 83.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.049 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -64.36 -45.26 88.54 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.956 0.408 . . . . 0.0 110.472 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.491 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.1 t80 -61.08 -60.99 2.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.179 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.539 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 85.5 m-20 -60.79 -18.93 58.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.025 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.413 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 0.8 OUTLIER -68.53 -70.15 0.28 Allowed 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.377 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 59.5 tp -63.5 -16.01 59.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.539 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 28.1 tt0 . . . . . 0 N--CA 1.45 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.647 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.0 mtt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.768 0.318 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 44.8 29.47 0.44 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.627 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.2 mtt180 45.27 29.76 0.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.561 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.525 HG22 ' O ' ' A' ' 4' ' ' ILE . 25.2 mm 50.61 47.67 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.208 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.447 ' N ' ' CD1' ' A' ' 5' ' ' TRP . 7.3 m95 33.89 37.58 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.773 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 34.01 36.83 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.931 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 48.1 mt -85.11 -68.47 0.72 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.626 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -140.41 81.36 1.8 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.761 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.454 ' CB ' ' HD3' ' A' ' 10' ' ' PRO . 0.3 OUTLIER -167.02 -56.27 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.336 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.454 ' HD3' ' CB ' ' A' ' 9' ' ' ASP . 51.4 Cg_exo -55.55 -58.89 0.91 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.229 1.953 . . . . 0.0 112.354 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.859 ' O ' HG23 ' A' ' 15' ' ' VAL . 8.4 ptm180 -57.06 -49.58 75.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.028 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -59.39 -36.13 75.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.855 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.496 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.23 -46.52 83.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.017 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.696 ' HA ' HD12 ' A' ' 17' ' ' LEU . 8.6 mt -66.86 -35.69 80.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.271 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.859 HG23 ' O ' ' A' ' 11' ' ' ARG . 26.3 t -70.54 -27.36 30.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.535 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.68 -49.13 11.29 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.098 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER -63.61 -57.77 9.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.566 0.698 . . . . 0.0 109.862 179.392 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.51 -48.67 68.79 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.745 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.744 ' O ' HG13 ' A' ' 23' ' ' VAL . 93.2 m -68.29 -37.55 80.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.714 0.292 . . . . 0.0 111.088 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.404 ' O ' HG22 ' A' ' 23' ' ' VAL . 38.7 t80 -60.11 -52.68 64.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.355 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.758 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.5 pp -66.51 -49.15 67.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.909 0.385 . . . . 0.0 110.804 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.758 ' N ' HD12 ' A' ' 21' ' ' LEU . 7.7 t80 -54.18 -49.23 69.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.767 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.849 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 22.1 m -65.76 -48.56 81.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.618 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.888 ' CD1' HD11 ' A' ' 28' ' ' ILE . 0.3 OUTLIER -52.35 -65.04 0.63 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.98 0.419 . . . . 0.0 111.373 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.882 ' HA ' HD12 ' A' ' 28' ' ' ILE . . . -57.64 -31.74 66.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.182 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.596 HD11 ' CE2' ' A' ' 22' ' ' PHE . 11.3 mt -63.99 -49.44 72.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.644 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.849 ' HG ' ' O ' ' A' ' 23' ' ' VAL . 3.6 mt -62.83 -37.89 88.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.914 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.888 HD11 ' CD1' ' A' ' 24' ' ' LEU . 14.6 mt -63.12 -62.88 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.124 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.555 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 3.2 m170 -59.94 -38.6 82.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.032 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.458 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 25.6 t80 -64.66 -45.25 87.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.732 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.472 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.8 OUTLIER -68.71 -47.61 75.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.407 -179.591 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.776 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.3 pp -65.97 -47.71 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.936 0.398 . . . . 0.0 110.305 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.776 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -61.9 -45.47 93.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.401 179.446 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.456 ' N ' HD12 ' A' ' 33' ' ' LEU . 30.6 t -62.09 -55.27 30.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.414 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.1 m -62.43 -39.58 93.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.301 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -64.61 -57.69 8.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.24 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -37.41 87.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.143 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.502 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 85.9 t80 -61.49 -66.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.011 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.0 t-20 -57.84 -20.44 36.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.233 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -68.68 -70.68 0.25 Allowed 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -63.44 -17.34 62.59 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.591 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 46.0 tp10 -63.45 -53.44 52.19 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.539 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.03 112.34 1.67 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.384 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.425 ' O ' ' CB ' ' A' ' 45' ' ' SER . . . -172.11 74.25 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.846 0.355 . . . . 0.0 110.753 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' 44' ' ' ALA . 0.8 OUTLIER 83.42 26.92 0.1 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.863 -179.732 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.5 p -149.28 -57.78 0.2 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.948 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.53 -60.32 0.62 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.89 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.36 76.92 3.73 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.561 2.174 . . . . 0.0 112.439 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.429 ' O ' ' N ' ' A' ' 51' ' ' THR . 3.0 m -94.5 126.24 46.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.178 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.453 ' O ' HG23 ' A' ' 51' ' ' THR . 1.4 pt20 41.78 -91.04 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.681 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -159.78 125.42 4.17 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.818 0.342 . . . . 0.0 110.849 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.898 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.746 0.308 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 2.6 m-90 38.89 34.07 0.09 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.673 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.734 ' HB3' HD12 ' A' ' 7' ' ' LEU . 14.1 mtp85 52.37 57.5 6.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.922 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.659 HG22 ' O ' ' A' ' 4' ' ' ILE . 4.1 mp 46.89 28.45 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.201 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER 35.12 32.86 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.811 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.416 ' N ' ' O ' ' A' ' 4' ' ' ILE . 4.1 mt-30 -171.59 20.19 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.734 HD12 ' HB3' ' A' ' 3' ' ' ARG . 13.0 mt -83.16 -59.13 2.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.035 0.445 . . . . 0.0 110.502 179.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -138.06 83.12 1.95 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.747 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.429 ' CB ' ' CD ' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -164.52 -64.49 0.01 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.836 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.429 ' CD ' ' CB ' ' A' ' 9' ' ' ASP . 10.7 Cg_endo -53.87 -53.47 6.37 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.506 2.137 . . . . 0.0 112.187 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.717 ' O ' HG23 ' A' ' 15' ' ' VAL . 38.1 ttp85 -55.38 -56.02 24.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.821 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -59.21 -30.73 68.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.738 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -63.6 -49.15 74.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.941 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.06 -36.15 82.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.285 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.717 HG23 ' O ' ' A' ' 11' ' ' ARG . 38.1 t -67.83 -27.61 38.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.081 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.12 -42.53 35.94 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.829 -0.7 . . . . 0.0 111.55 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.526 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -63.7 -61.49 2.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.24 0.543 . . . . 0.0 110.368 179.25 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HA ' HD21 ' A' ' 21' ' ' LEU . . . -54.88 -45.56 74.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.897 -179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.734 ' O ' HG13 ' A' ' 23' ' ' VAL . 96.4 m -68.09 -42.68 79.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.718 0.294 . . . . 0.0 111.212 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -60.75 -49.37 77.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.48 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.2 pp -65.71 -50.66 64.04 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.858 0.361 . . . . 0.0 110.848 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.783 ' N ' HD12 ' A' ' 21' ' ' LEU . 2.0 t80 -55.48 -49.98 71.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.66 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.734 HG13 ' O ' ' A' ' 19' ' ' THR . 22.3 m -63.4 -50.61 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.404 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.68 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -59.46 -34.74 72.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.983 0.421 . . . . 0.0 110.18 179.444 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.68 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -62.06 -53.57 53.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.954 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 23' ' ' VAL . 1.3 pp -62.94 -33.62 75.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.82 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 23' ' ' VAL . 2.0 mm? -62.66 -48.41 79.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.831 0.348 . . . . 0.0 110.701 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.615 HG22 HD23 ' A' ' 32' ' ' LEU . 9.2 mt -63.45 -54.32 34.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.159 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.545 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 t60 -58.98 -40.05 83.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.994 0.426 . . . . 0.0 110.81 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.494 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 24.0 t80 -65.09 -44.48 88.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.5 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.475 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 2.5 tp -68.59 -47.88 74.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.081 -0.247 . . . . 0.0 111.294 -179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.3 pp -65.49 -48.72 71.63 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.851 0.358 . . . . 0.0 110.173 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.783 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.5 OUTLIER -61.31 -41.71 97.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.206 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.7 t -62.79 -59.53 4.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.15 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.0 m -59.51 -48.18 82.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.505 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 2.6 pp20? -62.13 -43.52 98.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -66.58 -36.84 83.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.047 0.451 . . . . 0.0 110.473 179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.524 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 10.7 t80 -61.81 -65.74 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.711 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.521 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 58.4 m-80 -57.63 -22.05 43.21 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.986 0.422 . . . . 0.0 111.13 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -67.44 -70.57 0.25 Allowed 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.519 ' C ' HD12 ' A' ' 41' ' ' LEU . 4.5 pp -64.41 -14.84 58.87 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.031 177.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.524 ' HB2' ' O ' ' A' ' 38' ' ' PHE . 2.2 tt0 -63.4 -67.22 0.44 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.508 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.469 ' O ' ' N ' ' A' ' 45' ' ' SER . . . -167.82 -66.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.541 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 39.89 -86.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.469 ' N ' ' O ' ' A' ' 43' ' ' GLY . 16.1 p -70.69 -28.58 64.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.653 0.263 . . . . 0.0 111.413 -179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.4 p -87.05 -13.84 43.22 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.261 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.655 ' O ' HG23 ' A' ' 49' ' ' VAL . 10.9 tttt -77.25 142.67 68.2 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.665 0.269 . . . . 0.0 110.764 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -52.63 128.07 26.78 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.546 2.164 . . . . 0.0 112.388 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 47' ' ' LYS . 21.6 t -142.64 -48.4 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.963 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -164.24 84.34 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.884 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 26.2 p 52.46 86.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.101 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.1 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.291 -0.861 . . . . 0.0 110.887 -179.999 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 ptt? . . . . . 0 N--CA 1.488 1.433 0 CA-C-O 120.626 0.251 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.418 ' CD1' ' HG2' ' A' ' 10' ' ' PRO . 1.5 t-105 40.08 65.75 0.7 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.7 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 52.7 25.49 3.81 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.113 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 4' ' ' ILE . 11.3 mm 44.17 30.3 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.209 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.413 ' C ' ' O ' ' A' ' 4' ' ' ILE . 19.8 m95 32.55 51.23 0.23 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.521 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -171.75 -30.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.872 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 24.2 mt -81.41 -50.57 9.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.735 0.302 . . . . 0.0 110.963 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -103.49 -39.36 6.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.892 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t0 78.69 69.27 0.18 Allowed Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.839 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.434 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 32.2 Cg_exo -58.45 -38.01 92.1 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.693 2.262 . . . . 0.0 112.526 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.633 ' HA ' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -54.83 -66.16 0.45 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.567 -179.589 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.712 ' NE2' ' HB2' ' A' ' 13' ' ' ALA . 4.1 pp0? -58.36 -45.05 88.95 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.933 0.396 . . . . 0.0 111.465 -179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.712 ' HB2' ' NE2' ' A' ' 12' ' ' GLN . . . -60.87 -36.14 78.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.769 -179.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.633 HD23 ' HA ' ' A' ' 11' ' ' ARG . 0.6 OUTLIER -72.23 -41.34 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.619 0.247 . . . . 0.0 111.056 -179.654 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 12' ' ' GLN . 7.2 p -70.25 -26.57 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.592 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.76 -54.82 5.7 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.881 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.779 HD12 ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -63.12 -49.19 75.39 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.979 0.419 . . . . 0.0 110.91 179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.779 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -59.59 -47.34 85.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.746 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.715 ' O ' HG13 ' A' ' 23' ' ' VAL . 81.7 m -66.6 -50.6 62.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.39 -179.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -59.92 -44.51 94.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.738 0.304 . . . . 0.0 111.283 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.796 HD13 ' N ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -67.17 -54.81 17.73 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.967 0.413 . . . . 0.0 110.704 179.919 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.796 ' N ' HD13 ' A' ' 21' ' ' LEU . 65.9 t80 -53.82 -48.21 70.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.799 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.715 HG13 ' O ' ' A' ' 19' ' ' THR . 22.7 m -64.12 -49.31 81.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 111.661 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.552 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -58.27 -57.92 10.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.012 0.434 . . . . 0.0 111.265 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.5 73.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.815 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.547 ' C ' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -61.81 -37.35 84.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 0.0 110.891 -179.605 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 23' ' ' VAL . 1.9 mp -60.05 -56.52 20.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.604 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.0 mm -63.4 -28.7 45.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.809 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.533 ' O ' HD12 ' A' ' 33' ' ' LEU . 1.9 t-80 -62.79 -65.09 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.245 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 27' ' ' LEU . 2.3 p90 -62.43 -31.61 72.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.561 -179.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.511 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 1.5 tp -69.59 -51.69 39.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.826 -0.349 . . . . 0.0 110.911 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.518 ' C ' HD12 ' A' ' 32' ' ' LEU . 2.0 pp -64.29 -41.39 96.9 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 29' ' ' HIS . 11.9 mt -60.32 -59.06 6.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.589 178.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.403 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 2.4 t -59.98 -28.11 67.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.189 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.7 m -66.09 -52.69 46.41 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.977 0.418 . . . . 0.0 110.536 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 40' ' ' TRP . 6.2 tt0 -62.41 -45.14 94.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.624 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.468 ' O ' HD12 ' A' ' 41' ' ' LEU . 7.9 mmt-85 -64.74 -36.23 83.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.504 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.548 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.9 m-85 -61.21 -66.35 0.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.386 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 11.9 m-80 -59.81 -18.77 46.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.845 0.355 . . . . 0.0 111.16 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.404 ' HB2' ' O ' ' A' ' 36' ' ' GLU . 72.8 t-105 -68.11 -74.91 0.11 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.793 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.895 HD13 ' N ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -63.19 -15.21 56.2 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 178.183 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.895 ' N ' HD13 ' A' ' 41' ' ' LEU . 4.7 tt0 -63.07 -63.33 1.23 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.291 179.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 89.66 46.02 4.41 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.505 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.5 -47.29 73.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.819 0.342 . . . . 0.0 111.088 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -31.77 66.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.957 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.8 p -87.78 -74.04 0.46 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.958 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 4.5 tttt 72.7 146.6 0.12 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.787 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.403 ' O ' ' N ' ' A' ' 50' ' ' GLN . 57.0 Cg_endo -70.86 130.58 18.2 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.535 2.157 . . . . 0.0 112.313 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.7 t 62.74 -77.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.181 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' A' ' 48' ' ' PRO . 4.3 tt0 76.13 153.83 0.15 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.866 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.7 m -80.22 -65.4 1.01 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.886 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.579 ' O ' ' N ' ' A' ' 3' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.531 0.205 . . . . 0.0 111.097 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.632 ' O ' HD21 ' A' ' 7' ' ' LEU . 0.0 OUTLIER 47.38 -77.79 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.301 179.576 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.579 ' N ' ' O ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -69.16 -8.72 48.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.427 -179.282 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.426 ' CD1' ' HA ' ' A' ' 1' ' ' MET . 35.3 pt -72.91 -21.95 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.506 ' O ' ' CB ' ' A' ' 6' ' ' GLN . 1.0 OUTLIER -68.28 -12.92 61.81 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.357 178.473 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.506 ' CB ' ' O ' ' A' ' 5' ' ' TRP . 1.9 tt0 90.7 87.4 0.01 OUTLIER 'General case' 0 C--N 1.342 0.274 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.785 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.632 HD21 ' O ' ' A' ' 2' ' ' TRP . 0.1 OUTLIER -154.78 -42.42 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.024 -179.845 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -133.62 32.35 3.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.893 0.377 . . . . 0.0 110.913 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.3 p30 -72.39 162.25 74.84 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.807 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -48.37 -46.87 21.81 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.665 2.244 . . . . 0.0 112.718 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.48 -50.95 66.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.086 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -59.32 -39.59 83.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.759 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.483 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.11 -40.25 94.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.33 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' A' ' 17' ' ' LEU . 12.3 mt -66.02 -43.6 87.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.608 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.6 m -69.28 -22.01 25.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.624 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.41 -50.13 10.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.772 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -63.91 -55.73 20.49 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.643 0.735 . . . . 0.0 109.558 178.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.563 ' HA ' HD21 ' A' ' 21' ' ' LEU . . . -54.13 -38.28 65.28 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.528 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.754 ' O ' HG13 ' A' ' 23' ' ' VAL . 4.5 m -67.61 -42.87 81.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.828 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.431 ' O ' HG22 ' A' ' 23' ' ' VAL . 18.4 t80 -60.76 -51.84 67.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.089 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.745 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.6 pp -66.31 -47.73 72.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.611 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.745 ' N ' HD12 ' A' ' 21' ' ' LEU . 75.9 t80 -55.71 -48.61 74.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.766 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.754 HG13 ' O ' ' A' ' 19' ' ' THR . 25.3 m -65.24 -49.03 81.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.814 -179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.862 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -59.16 -44.81 92.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.913 0.387 . . . . 0.0 110.569 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.862 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -61.18 -56.82 16.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.238 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.84 -28.67 70.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.752 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.665 HD13 ' O ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -63.48 -60.43 3.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.736 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.513 HG22 HD23 ' A' ' 32' ' ' LEU . 5.1 mt -62.77 -44.98 99.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.621 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 39.8 m170 -60.23 -42.56 95.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.849 ' HA ' HD22 ' A' ' 33' ' ' LEU . 19.5 t80 -64.63 -38.38 90.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.591 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.469 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -70.38 -47.83 63.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.03 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.794 HD12 ' N ' ' A' ' 33' ' ' LEU . 3.3 pp -65.23 -51.51 60.49 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.892 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -59.4 -40.08 85.45 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.272 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.892 ' N ' HD23 ' A' ' 33' ' ' LEU . 27.4 t -61.51 -49.99 74.52 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.58 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.4 m -59.39 -44.17 92.84 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.025 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -62.63 -49.6 74.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -64.9 -32.31 73.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.486 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.516 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.7 m-85 -62.19 -63.97 1.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.442 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.528 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-80 -58.67 -21.68 54.91 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.1 0.476 . . . . 0.0 110.983 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.418 ' CD1' ' HB2' ' A' ' 45' ' ' SER . 0.0 OUTLIER -67.55 -70.49 0.25 Allowed 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 179.288 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.12 -15.41 56.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 13.3 tp10 -63.88 -50.97 66.69 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.709 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -167.18 -31.94 0.02 OUTLIER Glycine 0 C--N 1.333 0.362 0 C-N-CA 120.333 -0.937 . . . . 0.0 113.288 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.21 -45.25 89.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.859 0.329 . . . . 0.0 111.323 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.418 ' HB2' ' CD1' ' A' ' 40' ' ' TRP . 4.5 t -72.19 -25.75 61.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.177 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.9 p -86.84 -24.96 24.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.071 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.651 ' HD2' HG22 ' A' ' 51' ' ' THR . 12.4 mtmm -161.44 72.14 2.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.756 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.31 -44.44 0.55 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.523 2.149 . . . . 0.0 112.259 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.553 HG12 ' HG3' ' A' ' 50' ' ' GLN . 20.6 t -145.32 133.32 16.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.159 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.553 ' HG3' HG12 ' A' ' 49' ' ' VAL . 2.3 mt-30 45.13 38.66 3.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.407 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.651 HG22 ' HD2' ' A' ' 47' ' ' LYS . 11.0 p 53.48 55.52 8.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.044 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.82 -179.968 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 ptp . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.73 0.3 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 28.7 m95 38.41 57.05 1.75 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.62 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.677 ' CB ' HD12 ' A' ' 7' ' ' LEU . 20.4 mtp85 56.63 39.2 29.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.023 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.537 HG22 ' O ' ' A' ' 4' ' ' ILE . 22.5 mm 50.65 38.61 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.019 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 45.2 p90 35.23 35.57 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.789 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.444 ' O ' ' N ' ' A' ' 8' ' ' PHE . 14.2 tt0 -173.25 -84.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.862 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.677 HD12 ' CB ' ' A' ' 3' ' ' ARG . 8.1 mt 55.99 -83.74 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.743 0.306 . . . . 0.0 111.124 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.444 ' N ' ' O ' ' A' ' 6' ' ' GLN . 8.6 m-85 -136.21 80.78 1.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.794 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.522 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -71.78 -43.69 11.39 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.259 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 9' ' ' ASP . 51.6 Cg_exo -54.46 -36.72 88.92 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.3 2.0 . . . . 0.0 112.385 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.91 -69.38 0.16 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.411 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.596 ' O ' HG12 ' A' ' 15' ' ' VAL . 0.4 OUTLIER -55.58 -46.68 77.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.979 -179.655 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.37 -30.11 70.95 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.08 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.1 mt -69.94 -44.8 68.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.767 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 12' ' ' GLN . 10.6 p -68.91 -27.08 34.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.844 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -73.48 -55.27 6.18 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.62 -0.8 . . . . 0.0 111.746 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.78 HD12 ' N ' ' A' ' 18' ' ' ALA . 3.0 pp -61.69 -47.88 83.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.062 0.458 . . . . 0.0 110.51 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.78 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -58.42 -37.51 75.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.369 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.709 ' O ' HG13 ' A' ' 23' ' ' VAL . 19.0 m -67.08 -55.3 14.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.028 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -59.63 -44.33 93.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.334 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.894 HD23 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.03 -57.77 6.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.894 ' N ' HD23 ' A' ' 21' ' ' LEU . 72.5 t80 -50.63 -49.12 57.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.77 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.709 HG13 ' O ' ' A' ' 19' ' ' THR . 19.4 m -64.16 -50.28 77.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.737 0.303 . . . . 0.0 111.525 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.9 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 10.5 tp -52.83 -65.28 0.59 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.205 0.526 . . . . 0.0 111.072 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.63 -22.93 25.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.576 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.708 HD23 ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -66.34 -53.44 36.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.61 179.152 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.9 ' HG ' ' O ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -63.11 -46.9 85.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 110.551 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.695 HD13 HD12 ' A' ' 27' ' ' LEU . 39.3 mm -63.6 -61.33 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.968 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.439 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 25.1 t-80 -55.11 -43.18 73.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.218 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.869 ' HA ' HD22 ' A' ' 33' ' ' LEU . 57.0 t80 -61.52 -31.56 71.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.057 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.657 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.4 tt -72.87 -47.23 49.91 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.827 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.657 HD23 ' CG2' ' A' ' 31' ' ' ILE . 4.1 mt -64.75 -54.24 34.57 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.15 0.5 . . . . 0.0 110.017 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.875 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -56.35 -39.02 72.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.957 179.449 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.875 ' N ' HD23 ' A' ' 33' ' ' LEU . 3.6 m -60.72 -51.04 71.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.0 m -62.82 -38.1 89.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.747 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -63.83 -45.7 88.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.706 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.93 -36.82 85.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.452 . . . . 0.0 110.39 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.411 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.6 m-85 -61.4 -64.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.392 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.626 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 11.4 m-20 -60.77 -18.1 52.99 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.234 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.402 ' HA ' ' HB2' ' A' ' 44' ' ' ALA . 16.4 t-105 -69.75 -73.68 0.15 Allowed 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.757 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 pp -62.76 -16.71 58.99 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.195 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.626 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 6.7 mm-40 -64.78 -69.03 0.31 Allowed 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.675 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -168.1 33.83 0.2 Allowed Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.518 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.415 ' O ' ' CB ' ' A' ' 45' ' ' SER . . . -66.43 113.65 4.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.696 0.284 . . . . 0.0 111.155 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.415 ' CB ' ' O ' ' A' ' 44' ' ' ALA . 0.3 OUTLIER 80.51 26.48 0.29 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.996 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.4 p -149.06 -46.83 0.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.852 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.4 ' CE ' ' HD2' ' A' ' 48' ' ' PRO . 0.3 OUTLIER 63.34 130.12 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.49 ' O ' HG12 ' A' ' 49' ' ' VAL . 51.1 Cg_exo -53.09 109.14 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.433 2.089 . . . . 0.0 112.313 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.651 HG13 ' HG2' ' A' ' 50' ' ' GLN . 0.3 OUTLIER 55.77 -175.14 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.337 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.651 ' HG2' HG13 ' A' ' 49' ' ' VAL . 5.3 mt-30 78.06 74.2 0.06 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.845 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.0 t -79.96 139.5 37.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.944 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 71.6 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.907 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 mmt . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.753 0.311 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 9.8 m-90 39.14 67.06 0.47 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.714 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.476 ' CB ' ' HA ' ' A' ' 7' ' ' LEU . 1.9 mmt85 54.41 26.89 7.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.211 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.594 HG22 ' O ' ' A' ' 4' ' ' ILE . 19.8 mm 59.05 18.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.081 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.472 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 3.0 t-105 86.18 -23.98 0.14 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.728 0.299 . . . . 0.0 111.048 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.444 ' HB3' ' CB ' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -67.4 -31.55 71.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.932 0.396 . . . . 0.0 110.252 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.476 ' HA ' ' CB ' ' A' ' 3' ' ' ARG . 0.3 OUTLIER 59.12 81.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.759 179.323 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.437 ' CZ ' ' NH1' ' A' ' 3' ' ' ARG . 87.3 m-85 54.43 21.35 3.22 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.997 178.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.444 ' CB ' ' HB3' ' A' ' 6' ' ' GLN . 0.5 OUTLIER -73.15 -51.65 5.87 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.665 0.269 . . . . 0.0 110.91 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 9' ' ' ASP . 53.1 Cg_exo -55.17 -29.31 65.67 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.534 2.156 . . . . 0.0 112.295 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.839 ' O ' HG23 ' A' ' 15' ' ' VAL . 51.1 ttt-85 -63.78 -72.58 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.974 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -58.94 -35.97 73.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.98 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.493 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.19 -46.08 85.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.113 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 33.6 mt -66.13 -34.23 77.58 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.404 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.839 HG23 ' O ' ' A' ' 11' ' ' ARG . 35.3 t -68.21 -28.72 41.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.149 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.34 -43.41 31.48 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.617 179.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.538 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -63.3 -61.04 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.236 0.541 . . . . 0.0 110.424 179.416 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.86 -47.83 76.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.075 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.609 ' O ' HG13 ' A' ' 23' ' ' VAL . 89.7 m -66.0 -51.24 60.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.685 0.279 . . . . 0.0 111.29 -179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -59.61 -35.53 74.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.861 HD23 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -67.78 -61.26 1.96 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.678 179.655 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.861 ' N ' HD23 ' A' ' 21' ' ' LEU . 25.7 t80 -54.02 -44.22 70.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.986 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.609 HG13 ' O ' ' A' ' 19' ' ' THR . 29.2 m -65.2 -49.21 80.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.824 HD23 ' N ' ' A' ' 25' ' ' ALA . 0.2 OUTLIER -60.49 -45.25 94.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.893 0.378 . . . . 0.0 110.719 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.824 ' N ' HD23 ' A' ' 24' ' ' LEU . . . -59.99 -39.75 86.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.794 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.547 HD11 ' CE2' ' A' ' 22' ' ' PHE . 23.1 mt -64.38 -41.57 96.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.736 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 23' ' ' VAL . 6.3 mp -63.09 -57.46 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.077 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.696 HD12 ' N ' ' A' ' 29' ' ' HIS . 2.2 pp -60.75 -50.98 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.201 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.696 ' N ' HD12 ' A' ' 28' ' ' ILE . 32.4 t-80 -56.78 -38.1 72.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.909 0.385 . . . . 0.0 110.456 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.871 ' HA ' HD22 ' A' ' 33' ' ' LEU . 43.5 t80 -64.7 -33.78 76.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.892 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.661 ' CG2' HD23 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -71.24 -45.59 69.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.82 0.343 . . . . 0.0 110.651 179.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.661 HD23 ' CG2' ' A' ' 31' ' ' ILE . 3.7 mt -65.67 -53.99 33.68 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.08 0.467 . . . . 0.0 110.091 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.912 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -57.81 -40.99 81.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.228 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.912 ' N ' HD23 ' A' ' 33' ' ' LEU . 65.2 p -62.66 -49.79 73.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.722 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 11.9 m -61.77 -41.07 97.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.112 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.71 -53.22 54.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.92 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -63.85 -35.03 79.29 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.597 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 51.2 t80 -60.02 -66.3 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.429 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.649 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 13.4 m-80 -59.67 -17.55 34.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.034 0.445 . . . . 0.0 111.033 179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.401 ' CZ3' ' HA ' ' A' ' 45' ' ' SER . 0.6 OUTLIER -68.27 -75.98 0.1 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.819 179.505 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.409 ' C ' HD12 ' A' ' 41' ' ' LEU . 4.2 pp -62.92 -16.18 58.15 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.362 178.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.649 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 2.3 mm-40 -64.84 -55.95 16.4 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.806 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -167.33 -20.18 0.02 OUTLIER Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.532 -0.842 . . . . 0.0 113.42 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.63 -23.82 67.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.992 0.396 . . . . 0.0 111.313 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.401 ' HA ' ' CZ3' ' A' ' 40' ' ' TRP . 0.5 OUTLIER -72.17 -36.68 69.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.886 0.374 . . . . 0.0 110.709 179.788 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 11.7 p -88.29 -31.66 18.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.848 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 20.2 tttm 74.24 87.82 0.09 OUTLIER Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.853 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.431 ' O ' HG12 ' A' ' 49' ' ' VAL . 57.3 Cg_endo -70.92 -167.98 0.3 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.577 2.185 . . . . 0.0 112.296 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.523 HG13 ' N ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER 57.82 172.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.975 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.523 ' N ' HG13 ' A' ' 49' ' ' VAL . 0.0 OUTLIER -164.17 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.908 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.9 m -80.18 86.23 5.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.856 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.865 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.9 mtp . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.697 0.284 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 3.0 m0 40.37 33.26 0.16 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.718 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.715 ' HB3' HD11 ' A' ' 7' ' ' LEU . 28.2 mtt85 52.69 46.43 26.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.988 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.514 HG22 ' O ' ' A' ' 4' ' ' ILE . 14.7 mm 45.65 28.53 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.283 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.501 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 3.1 t90 90.41 -42.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.816 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.681 ' O ' HD12 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -176.21 -35.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.236 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.715 HD11 ' HB3' ' A' ' 3' ' ' ARG . 0.5 OUTLIER 69.41 -67.62 0.22 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.826 -179.542 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.502 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 3.6 m-85 -103.71 -60.0 1.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.895 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.666 ' HB3' ' HD3' ' A' ' 10' ' ' PRO . 5.9 t0 100.67 -60.6 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.68 0 C-N-CA 123.828 0.851 . . . . 0.0 111.981 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.666 ' HD3' ' HB3' ' A' ' 9' ' ' ASP . 52.2 Cg_exo -54.89 -34.41 85.68 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 121.747 1.631 . . . . 0.0 112.137 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.882 ' O ' HG23 ' A' ' 15' ' ' VAL . 1.1 tpm_? -69.63 -47.87 61.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.94 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -52.98 63.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.996 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.17 -33.14 74.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.042 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 13.4 mt -69.74 -39.76 76.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.593 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 11' ' ' ARG . 40.7 t -69.62 -28.35 37.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.674 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.05 -56.41 5.3 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.619 -0.801 . . . . 0.0 111.598 179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.727 HD12 ' N ' ' A' ' 18' ' ' ALA . 2.6 pp -62.57 -48.68 78.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.724 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.727 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -57.27 -47.47 81.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.26 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.779 ' O ' HG13 ' A' ' 23' ' ' VAL . 66.6 m -66.15 -34.71 78.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.623 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.43 ' O ' HG22 ' A' ' 23' ' ' VAL . 1.5 t80 -60.95 -55.68 30.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.111 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.6 pp -66.96 -42.78 84.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.784 0.326 . . . . 0.0 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -56.46 -51.21 69.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.415 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.779 HG13 ' O ' ' A' ' 19' ' ' THR . 17.3 m -64.92 -50.16 76.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.479 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.545 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.5 OUTLIER -55.6 -60.57 3.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.074 0.464 . . . . 0.0 110.952 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.476 ' HA ' HD11 ' A' ' 28' ' ' ILE . . . -58.39 -32.65 68.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.992 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.4 mt -65.1 -46.69 80.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.913 0.387 . . . . 0.0 110.627 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 23' ' ' VAL . 8.4 mp -62.2 -55.46 28.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.157 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 25' ' ' ALA . 16.6 pt -62.01 -45.89 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-O 120.8 0.333 . . . . 0.0 111.211 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.451 ' HA ' HD21 ' A' ' 32' ' ' LEU . 54.2 t60 -61.97 -36.71 82.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.649 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.28 -42.37 88.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.294 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.512 ' CG2' ' N ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -66.69 -50.06 69.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.319 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.642 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.4 pp -62.46 -26.67 68.64 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.642 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -61.3 -65.61 0.67 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.436 178.168 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.41 ' O ' ' CD1' ' A' ' 38' ' ' PHE . 11.7 m -59.37 -19.08 44.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.194 178.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.8 m -72.66 -63.14 1.22 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.98 0.419 . . . . 0.0 110.786 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.79 -39.06 87.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.469 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -36.47 84.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.05 0.452 . . . . 0.0 109.984 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.41 ' CD1' ' O ' ' A' ' 34' ' ' SER . 1.4 m-85 -62.25 -63.26 1.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.261 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.621 ' HA ' ' HB2' ' A' ' 42' ' ' GLU . 0.7 OUTLIER -61.15 -18.77 59.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.207 179.657 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 11.9 t-105 -69.98 -72.7 0.18 Allowed 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.83 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.5 tt -62.43 -17.26 58.88 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.164 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.621 ' HB2' ' HA ' ' A' ' 39' ' ' ASN . 10.9 mt-10 -64.21 -66.26 0.57 Allowed 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.537 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.441 ' O ' ' HD2' ' A' ' 48' ' ' PRO . . . -167.72 88.53 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.659 -0.782 . . . . 0.0 112.388 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.414 ' O ' ' CB ' ' A' ' 45' ' ' SER . . . -66.61 79.02 0.11 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.805 0.336 . . . . 0.0 110.902 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.414 ' CB ' ' O ' ' A' ' 44' ' ' ALA . 4.3 t 81.24 35.2 0.1 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.679 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 7.3 p -146.53 8.65 1.03 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.851 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HB3' ' CD ' ' A' ' 48' ' ' PRO . 10.5 ttpt -161.71 -65.96 0.02 OUTLIER Pre-proline 0 CA--C 1.532 0.284 0 C-N-CA 121.088 -0.245 . . . . 0.0 111.168 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.468 ' CD ' ' HB3' ' A' ' 47' ' ' LYS . 12.5 Cg_endo -55.61 -70.96 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.513 2.142 . . . . 0.0 112.241 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.44 HG12 ' N ' ' A' ' 50' ' ' GLN . 4.1 t -95.5 161.61 2.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.887 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.44 ' N ' HG12 ' A' ' 49' ' ' VAL . 20.9 mm-40 46.18 -167.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.162 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.6 33.67 15.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.001 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.0 m . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.913 -179.951 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.721 0.296 . . . . 0.0 111.241 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 60.5 m95 39.12 33.99 0.1 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.626 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.5 mtt85 51.64 48.23 23.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.086 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.577 HG22 ' O ' ' A' ' 4' ' ' ILE . 23.3 mm 46.63 29.61 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.241 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.51 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 0.9 OUTLIER 92.19 -43.82 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.924 -179.698 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 8' ' ' PHE . 5.7 pt20 -174.35 30.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.348 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.8 mt 59.46 -82.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.973 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.426 ' O ' ' CB ' ' A' ' 9' ' ' ASP . 18.2 m-85 -139.81 34.81 1.98 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.629 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.426 ' CB ' ' O ' ' A' ' 8' ' ' PHE . 0.9 OUTLIER 81.76 129.16 0.03 OUTLIER Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.677 -179.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.424 ' O ' HD12 ' A' ' 14' ' ' LEU . 34.4 Cg_exo -59.66 -35.06 96.07 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.331 2.021 . . . . 0.0 112.365 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.617 ' O ' HG22 ' A' ' 15' ' ' VAL . 0.1 OUTLIER -72.58 -61.49 1.78 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.281 -179.712 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -58.75 -42.03 87.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.954 0.407 . . . . 0.0 111.272 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.3 -43.53 90.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.527 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.424 HD12 ' O ' ' A' ' 10' ' ' PRO . 35.2 mt -67.5 -46.08 73.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.024 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.617 HG22 ' O ' ' A' ' 11' ' ' ARG . 35.5 m -70.0 -24.26 26.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.245 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.52 -56.6 4.98 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.998 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -63.91 -54.78 29.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.744 0.783 . . . . 0.0 109.856 179.208 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.83 -53.81 43.26 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.389 -1.278 . . . . 0.0 112.068 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.729 ' O ' HG13 ' A' ' 23' ' ' VAL . 47.9 m -66.56 -38.25 86.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.605 0.241 . . . . 0.0 111.311 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -59.86 -54.82 41.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.853 0.359 . . . . 0.0 111.261 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.756 HD12 ' N ' ' A' ' 22' ' ' PHE . 3.6 pp -65.72 -48.0 73.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.979 0.419 . . . . 0.0 110.751 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.756 ' N ' HD12 ' A' ' 21' ' ' LEU . 4.2 m-85 -53.53 -55.83 22.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.478 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.729 HG13 ' O ' ' A' ' 19' ' ' THR . 17.9 m -60.28 -48.04 89.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.821 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.534 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -52.03 -67.76 0.22 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.949 0.404 . . . . 0.0 110.845 179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.07 -24.75 64.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.995 179.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.823 HD12 HD22 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -65.22 -54.21 32.92 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.45 179.702 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.823 HD22 HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -62.88 -44.61 95.64 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.948 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.601 HG22 HD23 ' A' ' 32' ' ' LEU . 38.2 mm -62.9 -57.06 13.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.198 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.771 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 1.4 m-70 -61.41 -39.59 91.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.322 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.576 ' O ' HD23 ' A' ' 33' ' ' LEU . 68.8 t80 -60.78 -51.41 69.47 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.95 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.725 HD12 ' N ' ' A' ' 32' ' ' LEU . 2.2 pp -67.8 -50.61 58.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.798 HD12 ' N ' ' A' ' 33' ' ' LEU . 4.5 pp -60.32 -51.32 70.04 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.672 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.798 ' N ' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -62.73 -51.23 67.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.758 0.314 . . . . 0.0 110.355 179.349 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.72 ' H ' HD23 ' A' ' 33' ' ' LEU . 68.6 m -61.91 -70.8 0.17 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.3 m -43.03 -42.2 3.76 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.801 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -63.03 -47.94 80.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.993 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -35.48 81.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.65 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 4.7 m-85 -62.0 -66.35 0.55 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.636 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.53 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 44.1 m-20 -58.96 -20.19 50.12 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.127 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 27.6 t90 -67.99 -70.96 0.23 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tp -63.6 -16.11 59.98 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.007 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 1.6 tp10 -62.97 -70.94 0.18 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.5 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.627 ' O ' ' HB3' ' A' ' 44' ' ' ALA . . . -73.01 -97.38 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.575 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 43' ' ' GLY . . . 86.37 -73.42 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.105 0 C-N-CA 122.584 0.353 . . . . 0.0 111.097 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 97.8 p -72.71 -41.42 65.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.735 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.439 ' O ' ' CG ' ' A' ' 47' ' ' LYS . 6.7 p -88.51 -41.04 12.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.827 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.439 ' CG ' ' O ' ' A' ' 46' ' ' THR . 0.1 OUTLIER 52.1 168.19 0.04 OUTLIER Pre-proline 0 CA--C 1.532 0.25 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.488 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.1 -176.89 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.554 2.17 . . . . 0.0 112.322 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.657 ' O ' HG12 ' A' ' 49' ' ' VAL . 38.2 t 57.0 27.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.104 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 43.89 78.44 0.05 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.532 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.78 30.15 13.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.149 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.274 -0.869 . . . . 0.0 110.968 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 mmt . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.698 0.285 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 46.0 m95 38.62 71.48 0.16 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.687 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.675 ' C ' HD12 ' A' ' 4' ' ' ILE . 3.3 mmt-85 57.95 21.86 8.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.16 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.675 HD12 ' C ' ' A' ' 3' ' ' ARG . 3.6 mp 61.1 11.22 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.782 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.464 ' CB ' ' O ' ' A' ' 4' ' ' ILE . 0.6 OUTLIER 87.03 -12.0 0.55 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 179.563 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.725 ' O ' HD12 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -174.02 -26.64 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.562 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.725 HD12 ' O ' ' A' ' 6' ' ' GLN . 0.1 OUTLIER 70.96 8.05 6.4 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.876 0.37 . . . . 0.0 110.844 -179.127 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 63.46 30.71 15.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.65 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.441 ' HA ' ' HD2' ' A' ' 10' ' ' PRO . 46.5 m-20 37.22 94.07 0.05 OUTLIER Pre-proline 0 CA--C 1.532 0.252 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.882 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.441 ' HD2' ' HA ' ' A' ' 9' ' ' ASP . 9.8 Cg_endo -53.16 -54.0 5.77 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.499 2.132 . . . . 0.0 112.091 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.796 ' O ' HG23 ' A' ' 15' ' ' VAL . 5.0 ttt85 -57.76 -41.76 82.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.52 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.43 ' HB3' ' CB ' ' A' ' 9' ' ' ASP . 3.6 tp-100 -60.47 -41.72 94.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.866 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -45.6 85.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.746 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.443 ' C ' HD12 ' A' ' 14' ' ' LEU . 1.0 OUTLIER -69.29 -39.69 78.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.919 -179.514 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.796 HG23 ' O ' ' A' ' 11' ' ' ARG . 47.1 t -70.96 -27.4 29.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.713 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.42 -54.18 6.29 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.768 -0.73 . . . . 0.0 111.845 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.783 HD12 ' N ' ' A' ' 18' ' ' ALA . 2.7 pp -61.95 -49.98 73.94 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.933 0.397 . . . . 0.0 110.69 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.783 ' N ' HD12 ' A' ' 17' ' ' LEU . . . -57.32 -50.34 73.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.018 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.782 ' O ' HG13 ' A' ' 23' ' ' VAL . 87.2 m -67.48 -30.83 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.602 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -60.48 -61.03 2.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.377 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -65.38 -41.75 93.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.939 0.4 . . . . 0.0 110.773 -179.84 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.414 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 2.4 m-85 -55.62 -53.46 56.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.493 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.782 HG13 ' O ' ' A' ' 19' ' ' THR . 13.4 m -65.77 -49.6 76.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.677 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.546 ' N ' HG23 ' A' ' 23' ' ' VAL . 0.6 OUTLIER -55.05 -58.78 6.25 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.641 -179.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.89 -47.89 83.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.345 -179.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.554 ' C ' HD12 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -62.83 -42.62 99.8 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.428 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 23' ' ' VAL . 1.9 mm? -60.37 -55.6 31.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.808 0.337 . . . . 0.0 111.086 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.454 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 42.6 mt -61.81 -54.93 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.982 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.499 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 57.3 m80 -54.95 -38.82 68.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.666 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.87 ' HA ' HD22 ' A' ' 33' ' ' LEU . 20.2 t80 -64.67 -33.09 75.12 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.948 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.664 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.7 tt -71.65 -46.25 63.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.796 0.332 . . . . 0.0 110.626 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.664 HD23 ' CG2' ' A' ' 31' ' ' ILE . 4.0 mt -65.34 -54.51 27.94 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-O 121.157 0.503 . . . . 0.0 110.072 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.902 HD23 ' N ' ' A' ' 34' ' ' SER . 0.0 OUTLIER -56.85 -40.15 75.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.12 179.532 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.902 ' N ' HD23 ' A' ' 33' ' ' LEU . 19.9 t -62.24 -49.79 74.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.717 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.1 m -60.19 -46.12 90.81 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.091 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.415 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 5.4 tt0 -63.2 -43.66 97.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.87 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.03 -40.26 94.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.664 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.49 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 3.9 m-85 -61.0 -65.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.597 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.528 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.1 m-20 -59.37 -19.42 46.69 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.979 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.415 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 1.3 m0 -67.55 -71.41 0.21 Allowed 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tp -63.61 -15.8 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.092 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.528 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 18.5 tt0 -62.94 -68.94 0.3 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.639 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.626 ' O ' ' HB3' ' A' ' 44' ' ' ALA . . . -167.92 -59.6 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.374 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' A' ' 43' ' ' GLY . . . 87.3 17.16 0.08 Allowed 'General case' 0 C--O 1.231 0.131 0 C-N-CA 122.647 0.379 . . . . 0.0 111.686 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.88 32.76 3.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.877 0.37 . . . . 0.0 110.521 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 2.3 p -149.52 -34.99 0.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.378 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.5 tttm -75.74 -61.37 0.91 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.031 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.413 ' HD3' ' CA ' ' A' ' 43' ' ' GLY . 54.9 Cg_endo -70.0 105.89 1.61 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.467 2.111 . . . . 0.0 112.296 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.612 HG22 ' O ' ' A' ' 49' ' ' VAL . 14.7 p -145.23 37.72 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.047 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 44.81 79.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.405 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.422 HG22 ' N ' ' A' ' 52' ' ' SER . 4.0 m -158.45 -75.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.529 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.422 ' N ' HG22 ' A' ' 51' ' ' THR . 27.5 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.911 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.6 mmt . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.632 0.253 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 29.6 m95 38.63 70.74 0.19 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.599 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 48.84 32.66 3.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.476 HG22 ' O ' ' A' ' 4' ' ' ILE . 30.6 mm 50.88 54.08 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 6.5 m95 33.42 38.89 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.71 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 34.76 36.43 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.886 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 77.3 mt -85.06 -34.46 22.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.799 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -138.34 39.11 2.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 5.7 m-20 -71.98 161.53 78.32 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.737 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.474 ' O ' HD12 ' A' ' 14' ' ' LEU . 33.6 Cg_endo -64.63 -51.13 1.99 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.565 2.176 . . . . 0.0 112.424 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.882 ' O ' HG23 ' A' ' 15' ' ' VAL . 7.2 mmt180 -72.56 -48.93 36.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.129 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 -58.49 -52.77 64.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.136 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.513 ' O ' ' HG ' ' A' ' 17' ' ' LEU . . . -62.78 -36.57 83.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.474 HD12 ' O ' ' A' ' 10' ' ' PRO . 12.9 mt -66.63 -40.79 88.92 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.33 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.882 HG23 ' O ' ' A' ' 11' ' ' ARG . 43.8 t -68.08 -23.75 29.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.165 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.417 ' O ' ' CD1' ' A' ' 20' ' ' PHE . . . -74.28 -48.37 14.84 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.372 179.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -61.93 -57.03 13.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.353 0.596 . . . . 0.0 110.09 179.28 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.476 ' O ' HD13 ' A' ' 21' ' ' LEU . . . -53.24 -50.62 64.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.37 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.806 ' O ' HG13 ' A' ' 23' ' ' VAL . 81.2 m -66.82 -32.02 73.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.01 0.433 . . . . 0.0 110.683 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.417 ' CD1' ' O ' ' A' ' 16' ' ' GLY . 1.4 m-85 -60.06 -69.69 0.2 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.384 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.87 HD13 ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -63.05 -32.41 73.78 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.822 -179.553 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.87 ' N ' HD13 ' A' ' 21' ' ' LEU . 37.9 t80 -59.26 -58.09 10.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.927 0.394 . . . . 0.0 110.614 179.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.838 ' HA ' HD23 ' A' ' 26' ' ' LEU . 5.0 m -65.67 -52.15 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.388 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.669 HD13 HD13 ' A' ' 28' ' ' ILE . 0.7 OUTLIER -51.91 -56.85 11.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.161 0.505 . . . . 0.0 111.159 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.32 -33.71 71.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.897 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.838 HD23 ' HA ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER -64.76 -51.85 60.1 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.354 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.892 HD12 ' CD1' ' A' ' 28' ' ' ILE . 0.0 OUTLIER -66.28 -49.01 68.57 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.842 0.353 . . . . 0.0 111.068 179.853 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.892 ' CD1' HD12 ' A' ' 27' ' ' LEU . 1.6 mp -60.66 -58.67 6.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.712 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.612 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 20.7 t-80 -54.46 -34.09 60.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.851 0.358 . . . . 0.0 110.695 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.853 ' HA ' HD22 ' A' ' 33' ' ' LEU . 82.2 t80 -63.9 -38.47 91.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.813 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.68 ' CG2' HD23 ' A' ' 32' ' ' LEU . 1.4 tp -72.23 -46.59 57.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.67 0.272 . . . . 0.0 111.253 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.68 HD23 ' CG2' ' A' ' 31' ' ' ILE . 2.8 mt -64.5 -54.08 38.01 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.95 0.405 . . . . 0.0 110.421 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.853 HD22 ' HA ' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -57.42 -40.03 77.45 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.165 179.701 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.847 ' N ' HD23 ' A' ' 33' ' ' LEU . 26.4 t -61.61 -56.7 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.148 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.7 m -60.58 -48.88 79.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.413 ' O ' ' CG ' ' A' ' 40' ' ' TRP . 7.2 tt0 -62.46 -36.68 83.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.049 -179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -64.36 -45.26 88.54 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.956 0.408 . . . . 0.0 110.472 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.491 ' O ' ' HB2' ' A' ' 42' ' ' GLU . 1.1 t80 -61.08 -60.99 2.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.179 179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.539 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 85.5 m-20 -60.79 -18.93 58.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.025 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.413 ' CG ' ' O ' ' A' ' 36' ' ' GLU . 0.8 OUTLIER -68.53 -70.15 0.28 Allowed 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 179.377 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 59.5 tp -63.5 -16.01 59.47 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.539 ' HB3' ' HA ' ' A' ' 39' ' ' ASN . 28.1 tt0 -63.77 -70.55 0.21 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.647 179.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 47' ' ' LYS . . . -74.02 -3.91 65.96 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.994 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.89 -30.87 71.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.054 0.427 . . . . 0.0 110.985 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.0 m -75.53 0.58 16.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.096 -179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 6.2 p -146.8 -51.13 0.21 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.668 0.27 . . . . 0.0 111.404 -179.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.491 ' N ' ' O ' ' A' ' 43' ' ' GLY . 4.6 mttt 64.14 164.1 0.12 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.971 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -61.98 -57.8 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.557 2.171 . . . . 0.0 112.456 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.5 t -145.68 -54.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.249 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 77.02 134.31 0.06 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.841 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 23.1 m -80.42 82.17 6.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.881 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.901 179.984 . . . . . . . . 0 0 . 1 stop_ save_